#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bry s VAL 2 N 0.00 1.22 0.01 2.53 -7.23 -0.96 -5.05 120.40 110.92 1bry s VAL 2 Ca 0.00 -1.85 -0.06 0.00 -1.81 0.00 0.00 61.98 58.26 1bry s VAL 2 Cb 0.00 -1.63 -0.00 0.00 0.56 0.00 0.00 36.38 35.31 1bry s VAL 2 CO 0.00 -0.57 0.11 -0.55 -0.31 0.00 0.00 175.10 173.78 1bry s SER 3 N -2.74 0.07 -0.02 4.85 0.15 -1.26 -0.80 113.70 113.94 1bry s SER 3 Ca 0.12 -0.28 -0.00 0.00 0.70 0.00 0.00 55.95 56.49 1bry s SER 3 Cb -0.02 0.19 0.03 0.00 -1.71 0.00 0.00 66.02 64.51 1bry s SER 3 CO 0.02 -0.37 0.04 0.12 1.20 0.00 0.00 173.24 174.24 1bry s PHE 4 N -1.50 0.02 -0.18 3.44 5.36 -0.03 -4.81 117.98 120.28 1bry s PHE 4 Ca -0.14 0.16 -0.02 0.00 -0.96 0.00 0.00 56.93 55.96 1bry s PHE 4 Cb -0.07 -0.24 -0.01 0.00 -0.34 0.00 0.00 43.02 42.35 1bry s PHE 4 CO 0.01 -0.10 -0.08 1.03 -1.46 0.00 0.00 175.22 174.62 1bry s ARG 5 N 1.14 3.40 0.30 10.12 0.52 -1.26 -1.73 118.95 131.44 1bry s ARG 5 Ca -0.08 -0.64 0.09 0.00 -0.52 0.00 0.00 55.73 54.58 1bry s ARG 5 Cb -0.13 -2.84 0.47 0.00 0.52 0.00 0.00 34.95 32.97 1bry s ARG 5 CO -0.03 0.00 1.69 -0.07 0.02 0.00 0.00 175.30 176.91 1bry h LEU 6 N 7.43 0.11 -9.10 2.53 -0.00 -1.08 -3.36 115.31 111.84 1bry h LEU 6 Ca -0.35 -0.05 -0.56 0.00 -0.00 0.00 0.00 57.88 56.92 1bry h LEU 6 Cb 1.18 -0.03 -0.01 0.00 -0.00 0.00 0.00 40.66 41.80 1bry h LEU 6 CO 0.59 0.58 1.18 -0.55 -0.00 0.00 0.00 178.44 180.25 1bry s SER 7 N -6.89 6.32 0.00 -0.43 0.15 -1.26 -1.17 113.70 110.42 1bry s SER 7 Ca -0.03 1.88 0.00 0.00 0.70 0.00 0.00 55.95 58.50 1bry s SER 7 Cb 0.13 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.91 1bry s SER 7 CO 0.76 -1.27 0.00 0.61 1.20 0.00 0.00 173.24 174.54 1bry n GLY 8 N 4.70 0.56 3.76 9.45 0.00 -1.26 -5.01 105.19 117.38 1bry n GLY 8 Ca 0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.84 1bry n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bry s ALA 9 N -2.05 2.82 0.18 4.61 0.00 -0.32 -5.01 121.76 121.99 1bry s ALA 9 Ca 0.00 1.17 0.00 0.00 0.00 0.00 0.00 51.96 53.14 1bry s ALA 9 Cb 0.00 -3.50 -0.04 0.00 0.00 0.00 0.00 23.12 19.58 1bry s ALA 9 CO 0.00 -1.14 0.06 0.95 0.00 0.00 0.00 175.76 175.63 1bry s THR 10 N -1.41 0.38 0.25 0.00 -4.23 -1.26 -5.01 115.64 104.36 1bry s THR 10 Ca 0.70 -1.97 -0.04 0.00 -1.18 0.00 0.00 61.69 59.21 1bry s THR 10 Cb -0.36 -2.25 0.23 0.00 1.34 0.00 0.00 72.50 71.46 1bry s THR 10 CO 0.42 -0.31 1.84 0.74 -0.54 0.00 0.00 174.62 176.77 1bry h THR 11 N 2.67 0.99 -0.27 3.99 2.02 -1.96 -1.22 112.91 119.13 1bry h THR 11 Ca -0.36 -0.32 -0.02 0.00 0.77 0.00 0.00 66.41 66.47 1bry h THR 11 Cb 1.22 -0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 67.57 1bry h THR 11 CO 0.60 0.17 0.10 0.74 0.37 0.00 0.00 175.52 177.50 1bry h THR 12 N 0.95 1.18 -0.06 3.16 2.02 -1.96 -2.01 112.91 116.19 1bry h THR 12 Ca 0.41 -0.56 -0.04 0.00 0.77 0.00 0.00 66.41 66.99 1bry h THR 12 Cb 0.28 1.05 -0.01 0.00 -1.74 0.00 0.00 68.15 67.73 1bry h THR 12 CO -0.21 0.19 -0.15 0.77 0.37 0.00 0.00 175.52 176.49 1bry h SER 13 N 0.28 0.09 -0.26 4.18 4.64 -1.83 -1.12 113.55 119.53 1bry h SER 13 Ca 0.09 -0.02 -0.15 0.00 -0.47 0.00 0.00 61.79 61.24 1bry h SER 13 Cb 0.20 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.26 1bry h SER 13 CO -0.01 0.25 -0.41 0.22 -0.87 0.00 0.00 176.83 176.02 1bry h TYR 14 N 0.09 0.98 -0.81 4.77 3.20 -0.98 -1.77 116.97 122.45 1bry h TYR 14 Ca 0.02 -0.29 -0.01 0.00 3.14 0.00 0.00 58.73 61.59 1bry h TYR 14 Cb 0.33 -0.20 -0.04 0.00 1.54 0.00 0.00 36.73 38.36 1bry h TYR 14 CO 0.00 1.08 0.47 0.78 -1.64 0.00 0.00 178.16 178.86 1bry h GLY 15 N 0.87 1.18 0.90 1.82 0.00 -0.62 -0.84 103.07 106.38 1bry h GLY 15 Ca 0.05 -0.51 -0.02 0.00 0.00 0.00 0.00 47.33 46.85 1bry h GLY 15 CO 0.09 0.49 0.09 -2.08 0.00 0.00 0.00 176.54 175.13 1bry h VAL 16 N 1.11 1.20 -0.28 4.60 2.07 -1.04 -0.96 116.25 122.95 1bry h VAL 16 Ca 0.29 -0.66 0.06 0.00 0.82 0.00 0.00 66.70 67.21 1bry h VAL 16 Cb -0.02 1.08 -0.05 0.00 -1.52 0.00 0.00 31.29 30.77 1bry h VAL 16 CO -0.05 0.22 -0.05 0.15 0.02 0.00 0.00 177.57 177.86 1bry h PHE 17 N 0.32 -0.11 -0.76 1.57 3.57 -0.93 0.19 116.94 120.79 1bry h PHE 17 Ca 0.10 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.58 1bry h PHE 17 Cb 0.25 0.09 -0.03 0.00 2.79 0.00 0.00 35.95 39.05 1bry h PHE 17 CO 0.01 -0.10 0.32 0.82 -2.23 0.00 0.00 178.31 177.12 1bry h ILE 18 N 0.02 1.25 -0.55 1.41 1.08 -0.96 0.95 117.51 120.71 1bry h ILE 18 Ca 0.14 -0.76 -0.03 0.00 -0.39 0.00 0.00 64.86 63.82 1bry h ILE 18 Cb 0.20 0.32 -0.02 0.00 -3.07 0.00 0.00 36.82 34.25 1bry h ILE 18 CO -0.28 0.31 0.22 0.50 -0.69 0.00 0.00 178.15 178.21 1bry h LYS 19 N 1.09 0.83 -0.09 2.37 3.64 -0.87 -1.44 116.57 122.09 1bry h LYS 19 Ca 0.26 -0.15 0.01 0.00 -1.27 0.00 0.00 60.65 59.50 1bry h LYS 19 Cb 0.18 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 1bry h LYS 19 CO -0.03 0.72 0.01 -0.91 -2.27 0.00 0.00 179.45 176.98 1bry h ASN 20 N 0.75 -0.01 -0.23 4.20 2.35 -0.40 -1.63 115.58 120.62 1bry h ASN 20 Ca 0.18 0.02 0.04 0.00 -0.55 0.00 0.00 56.30 55.99 1bry h ASN 20 Cb 0.20 0.03 -0.04 0.00 0.05 0.00 0.00 38.32 38.56 1bry h ASN 20 CO -0.01 0.01 -0.02 0.25 -1.65 0.00 0.00 177.43 176.00 1bry h LEU 21 N 0.05 -0.14 -0.96 1.61 5.85 -0.64 -1.03 115.31 120.05 1bry h LEU 21 Ca 0.04 0.06 0.06 0.00 0.84 0.00 0.00 57.88 58.88 1bry h LEU 21 Cb 0.04 0.11 -0.06 0.00 0.37 0.00 0.00 40.66 41.12 1bry h LEU 21 CO -0.06 -0.04 0.62 0.03 -0.34 0.00 0.00 178.44 178.64 1bry h ARG 22 N 0.04 1.11 0.00 1.25 3.08 -1.11 -2.06 114.38 116.69 1bry h ARG 22 Ca 0.11 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1bry h ARG 22 Cb 0.15 -0.25 0.00 0.00 0.08 0.00 0.00 29.97 29.95 1bry h ARG 22 CO -0.20 0.73 0.00 0.39 -1.07 0.00 0.00 179.97 179.82 1bry n GLU 23 N -4.52 0.19 0.00 0.04 1.02 -0.63 -2.66 120.64 114.08 1bry n GLU 23 Ca 0.14 0.04 0.13 0.00 -0.02 0.00 0.00 57.16 57.46 1bry n GLU 23 Cb 0.16 -1.50 0.44 0.00 -0.02 0.00 0.00 31.44 30.52 1bry n GLU 23 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1bry n ALA 24 N -1.39 3.02 -2.76 0.62 0.00 -0.44 -4.84 120.51 114.72 1bry n ALA 24 Ca 0.09 -0.32 -0.36 0.00 0.00 0.00 0.00 53.44 52.85 1bry n ALA 24 Cb 0.26 -1.22 -0.07 0.00 0.00 0.00 0.00 19.45 18.41 1bry n ALA 24 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1bry s LEU 25 N -2.65 4.27 0.44 0.00 1.43 -1.09 -5.03 118.68 116.06 1bry s LEU 25 Ca 0.22 0.37 -0.24 0.00 -1.03 0.00 0.00 54.13 53.44 1bry s LEU 25 Cb 0.19 -2.15 -0.08 0.00 0.03 0.00 0.00 46.19 44.18 1bry s LEU 25 CO 0.55 0.23 1.23 -2.84 0.23 0.00 0.00 176.35 175.75 1bry s PRO 26 N -0.04 3.80 0.02 1.29 0.02 -1.26 -5.04 135.00 133.79 1bry s PRO 26 Ca 0.12 1.96 0.09 0.00 0.02 0.00 0.00 61.00 63.19 1bry s PRO 26 Cb -0.12 -2.55 -0.03 0.00 0.02 0.00 0.00 34.50 31.83 1bry s PRO 26 CO 0.01 -0.57 -0.26 0.71 -0.33 0.00 0.00 177.00 176.57 1bry s TYR 27 N -1.40 2.34 0.09 6.54 2.02 -1.26 -3.76 117.35 121.93 1bry s TYR 27 Ca 0.61 -0.41 -0.09 0.00 -0.37 0.00 0.00 57.07 56.81 1bry s TYR 27 Cb -0.33 -1.43 -0.19 0.00 -0.40 0.00 0.00 41.96 39.60 1bry s TYR 27 CO 0.41 0.08 1.22 1.49 -1.57 0.00 0.00 175.55 177.18 1bry h GLU 28 N 5.00 0.53 0.00 -0.62 4.81 -0.91 -3.46 114.58 119.92 1bry h GLU 28 Ca -0.45 -0.62 0.00 0.00 -0.13 0.00 0.00 59.36 58.16 1bry h GLU 28 Cb 1.14 0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.70 1bry h GLU 28 CO 0.45 1.24 0.00 2.89 -0.73 0.00 0.00 179.01 182.86 1bry n ARG 29 N -3.77 -0.97 -5.03 1.92 1.85 -1.25 -5.04 116.66 104.37 1bry n ARG 29 Ca -0.10 0.00 -0.30 0.00 -1.00 0.00 0.00 57.85 56.46 1bry n ARG 29 Cb 0.90 0.00 -0.15 0.00 -1.05 0.00 0.00 32.46 32.15 1bry n ARG 29 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 1bry s LYS 30 N -0.26 1.85 -0.14 2.89 1.02 -1.26 -0.58 119.74 123.25 1bry s LYS 30 Ca 0.00 -0.98 0.01 0.00 0.02 0.00 0.00 55.97 55.02 1bry s LYS 30 Cb 0.00 -1.90 0.02 0.00 -0.52 0.00 0.00 37.83 35.42 1bry s LYS 30 CO 0.00 0.51 -0.16 0.08 -0.92 0.00 0.00 175.35 174.86 1bry s VAL 31 N -0.70 1.68 -1.46 3.17 1.01 -0.10 -4.59 120.40 119.41 1bry s VAL 31 Ca 0.10 -0.72 -0.09 0.00 0.00 0.00 0.00 61.98 61.28 1bry s VAL 31 Cb -0.10 -1.54 0.04 0.00 0.00 0.00 0.00 36.38 34.79 1bry s VAL 31 CO 0.01 0.48 0.78 -1.22 0.00 0.00 0.00 175.10 175.14 1bry n TYR 32 N 4.54 -2.18 -1.39 5.22 4.01 -1.26 -0.95 117.16 125.15 1bry n TYR 32 Ca -0.18 0.70 -0.13 0.00 -0.16 0.00 0.00 57.90 58.12 1bry n TYR 32 Cb 0.50 -4.11 -0.06 0.00 -0.31 0.00 0.00 39.34 35.36 1bry n TYR 32 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1bry n ASN 33 N -2.64 -4.96 -4.38 7.72 5.15 -1.26 -4.99 115.26 109.89 1bry n ASN 33 Ca -0.03 0.33 -0.34 0.00 -0.60 0.00 0.00 54.58 53.94 1bry n ASN 33 Cb 0.57 -3.65 -0.14 0.00 -0.53 0.00 0.00 39.78 36.04 1bry n ASN 33 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1bry s ILE 34 N -2.39 3.43 0.16 -1.44 1.01 -0.12 -5.04 121.20 116.82 1bry s ILE 34 Ca 0.00 -0.50 -0.34 0.00 0.00 0.00 0.00 60.65 59.81 1bry s ILE 34 Cb 0.00 -2.51 -0.14 0.00 0.01 0.00 0.00 42.46 39.82 1bry s ILE 34 CO 0.00 0.47 1.50 -2.65 0.00 0.00 0.00 174.94 174.26 1bry n PRO 35 N 4.04 1.95 -3.57 2.79 -0.02 -1.26 -0.93 135.00 138.00 1bry n PRO 35 Ca -0.18 0.70 -0.40 0.00 -2.02 0.00 0.00 63.50 61.61 1bry n PRO 35 Cb 0.52 -2.42 -0.11 0.00 -0.02 0.00 0.00 33.50 31.47 1bry n PRO 35 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1bry s LEU 36 N 0.69 4.35 0.72 2.45 2.96 0.25 -0.61 118.68 129.49 1bry s LEU 36 Ca 0.78 -0.41 -0.14 0.00 -0.22 0.00 0.00 54.13 54.13 1bry s LEU 36 Cb -0.72 -2.10 0.03 0.00 0.50 0.00 0.00 46.19 43.91 1bry s LEU 36 CO 0.42 -0.21 1.16 -0.76 -1.32 0.00 0.00 176.35 175.64 1bry s LEU 37 N 1.69 3.28 0.59 -0.68 1.43 -0.36 -0.34 118.68 124.30 1bry s LEU 37 Ca 0.06 2.17 -0.19 0.00 -1.03 0.00 0.00 54.13 55.14 1bry s LEU 37 Cb -0.17 -4.57 -0.04 0.00 0.03 0.00 0.00 46.19 41.44 1bry s LEU 37 CO 0.09 -2.08 1.21 -0.13 0.23 0.00 0.00 176.35 175.67 1bry s ARG 38 N -4.11 3.02 -0.02 1.70 1.81 -1.25 -4.17 118.95 115.93 1bry s ARG 38 Ca 0.70 1.82 -0.26 0.00 -1.72 0.00 0.00 55.73 56.28 1bry s ARG 38 Cb -0.24 -1.95 -0.20 0.00 -0.45 0.00 0.00 34.95 32.10 1bry s ARG 38 CO 0.46 -1.17 1.27 0.77 -0.68 0.00 0.00 175.30 175.95 1bry h SER 39 N 0.95 0.02 -5.00 0.23 0.02 -1.93 -3.44 113.55 104.40 1bry h SER 39 Ca -0.50 -0.49 -0.09 0.00 -0.84 0.00 0.00 61.79 59.87 1bry h SER 39 Cb 1.29 -0.01 -0.19 0.00 0.14 0.00 0.00 62.40 63.64 1bry h SER 39 CO 0.55 0.51 -0.06 -0.94 -1.14 0.00 0.00 176.83 175.75 1bry s SER 40 N -5.72 -0.39 -0.07 3.07 1.04 -1.26 -4.85 113.70 105.52 1bry s SER 40 Ca -0.16 0.33 -0.05 0.00 0.48 0.00 0.00 55.95 56.54 1bry s SER 40 Cb 0.02 0.42 0.02 0.00 0.10 0.00 0.00 66.02 66.58 1bry s SER 40 CO 0.68 -0.54 0.18 -0.63 0.98 0.00 0.00 173.24 173.91 1bry s ILE 41 N -1.44 -0.01 0.24 -1.02 1.01 -1.26 -5.12 121.20 113.60 1bry s ILE 41 Ca -0.11 0.05 0.07 0.00 0.00 0.00 0.00 60.65 60.65 1bry s ILE 41 Cb -0.03 -0.27 -0.04 0.00 0.01 0.00 0.00 42.46 42.14 1bry s ILE 41 CO 0.06 0.02 0.22 -0.94 0.00 0.00 0.00 174.94 174.29 1bry s SER 42 N 0.44 5.64 0.37 3.58 1.04 -1.26 -4.53 113.70 118.98 1bry s SER 42 Ca -0.03 -0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.21 1bry s SER 42 Cb -0.04 -1.48 0.00 0.00 0.10 0.00 0.00 66.02 64.60 1bry s SER 42 CO -0.02 -0.03 0.00 0.61 0.98 0.00 0.00 173.24 174.78 1bry n GLY 43 N -1.14 -0.62 0.30 7.32 0.00 -1.26 -3.68 105.19 106.12 1bry n GLY 43 Ca -0.08 -1.14 0.17 0.00 0.00 0.00 0.00 46.02 44.97 1bry n GLY 43 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1bry h SER 44 N 0.00 0.00 0.10 1.61 4.64 -1.94 -2.41 113.55 115.55 1bry h SER 44 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1bry h SER 44 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1bry h SER 44 CO 0.00 0.03 0.00 1.23 -0.87 0.00 0.00 176.83 177.22 1bry h GLY 45 N 0.35 0.00 2.00 -0.77 0.00 -1.94 -1.51 103.07 101.21 1bry h GLY 45 Ca -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 1bry h GLY 45 CO 0.00 0.00 -0.01 -0.09 0.00 0.00 0.00 176.54 176.44 1bry h ARG 46 N 0.00 0.00 -6.63 4.80 2.43 -1.59 -3.45 114.38 109.93 1bry h ARG 46 Ca 0.00 0.00 -0.66 0.00 -0.81 0.00 0.00 59.98 58.51 1bry h ARG 46 Cb 0.05 0.00 -0.19 0.00 -0.42 0.00 0.00 29.97 29.42 1bry h ARG 46 CO 0.00 0.01 -0.82 0.71 -1.51 0.00 0.00 179.97 178.36 1bry s TYR 47 N -3.61 2.33 0.03 2.20 2.02 -0.57 -0.71 117.35 119.04 1bry s TYR 47 Ca 0.02 -0.35 -0.04 0.00 -0.37 0.00 0.00 57.07 56.33 1bry s TYR 47 Cb 0.08 -1.16 -0.02 0.00 -0.40 0.00 0.00 41.96 40.46 1bry s TYR 47 CO 0.56 0.49 0.05 -0.08 -1.57 0.00 0.00 175.55 175.00 1bry s THR 48 N -1.61 0.13 -0.07 -0.71 -1.32 -0.39 -4.90 115.64 106.76 1bry s THR 48 Ca 0.20 -1.07 0.01 0.00 -1.21 0.00 0.00 61.69 59.63 1bry s THR 48 Cb -0.08 -0.72 -0.03 0.00 -1.51 0.00 0.00 72.50 70.16 1bry s THR 48 CO 0.10 -0.59 -0.09 -0.76 -2.21 0.00 0.00 174.62 171.07 1bry s LEU 49 N -1.92 3.04 -0.10 9.08 1.43 -1.26 -1.01 118.68 127.94 1bry s LEU 49 Ca -0.08 -0.09 0.03 0.00 -1.03 0.00 0.00 54.13 52.96 1bry s LEU 49 Cb -0.03 -1.66 -0.01 0.00 0.03 0.00 0.00 46.19 44.52 1bry s LEU 49 CO -0.03 0.33 -0.19 -0.76 0.23 0.00 0.00 176.35 175.93 1bry s LEU 50 N -0.64 2.38 -0.18 1.79 1.02 -0.29 -2.26 118.68 120.50 1bry s LEU 50 Ca 0.10 -0.42 -0.03 0.00 0.02 0.00 0.00 54.13 53.79 1bry s LEU 50 Cb -0.11 -1.49 -0.02 0.00 0.02 0.00 0.00 46.19 44.59 1bry s LEU 50 CO 0.02 0.20 -0.05 -1.00 0.02 0.00 0.00 176.35 175.53 1bry s HIS 51 N 0.11 2.95 -0.11 0.29 3.76 0.02 -0.11 115.29 122.19 1bry s HIS 51 Ca -0.09 -0.66 0.03 0.00 -0.15 0.00 0.00 55.06 54.18 1bry s HIS 51 Cb -0.15 -2.01 0.01 0.00 1.11 0.00 0.00 32.58 31.53 1bry s HIS 51 CO 0.06 -0.32 -0.21 -0.51 -0.85 0.00 0.00 174.74 172.91 1bry s LEU 52 N 0.93 2.00 -0.10 0.89 1.43 -0.26 -0.85 118.68 122.71 1bry s LEU 52 Ca -0.01 -0.53 0.03 0.00 -1.03 0.00 0.00 54.13 52.60 1bry s LEU 52 Cb -0.15 -1.32 -0.00 0.00 0.03 0.00 0.00 46.19 44.75 1bry s LEU 52 CO 0.01 0.10 -0.23 -0.89 0.23 0.00 0.00 176.35 175.57 1bry s THR 53 N 0.62 2.17 0.80 5.49 2.01 -0.70 -1.19 115.64 124.84 1bry s THR 53 Ca -0.13 -0.98 -0.12 0.00 0.31 0.00 0.00 61.69 60.77 1bry s THR 53 Cb -0.17 -1.84 0.18 0.00 0.01 0.00 0.00 72.50 70.69 1bry s THR 53 CO 0.03 0.56 1.09 -0.46 -0.69 0.00 0.00 174.62 175.15 1bry n ASN 54 N 3.54 0.27 -0.01 3.53 0.23 -0.18 -0.60 115.26 122.04 1bry n ASN 54 Ca -0.19 -1.51 0.09 0.00 -0.53 0.00 0.00 54.58 52.44 1bry n ASN 54 Cb 0.53 -0.81 0.50 0.00 -2.08 0.00 0.00 39.78 37.91 1bry n ASN 54 CO 0.00 0.00 0.00 1.88 -0.93 0.00 0.00 177.26 178.21 1bry h TYR 55 N -1.47 0.40 -0.14 -2.53 0.05 -1.89 -1.67 116.97 109.71 1bry h TYR 55 Ca -0.35 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.44 1bry h TYR 55 Cb 1.02 -0.13 0.00 0.00 1.01 0.00 0.00 36.73 38.62 1bry h TYR 55 CO 0.00 0.22 0.00 0.00 -1.05 0.00 0.00 178.16 177.33 1bry n ALA 56 N -2.51 2.48 -1.85 3.88 0.00 -1.26 -4.71 120.51 116.54 1bry n ALA 56 Ca 0.06 -0.26 -0.11 0.00 0.00 0.00 0.00 53.44 53.13 1bry n ALA 56 Cb 0.23 -1.00 -0.02 0.00 0.00 0.00 0.00 19.45 18.66 1bry n ALA 56 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1bry n ASP 57 N -0.08 -3.93 -4.71 0.00 2.03 -0.63 -5.01 116.55 104.22 1bry n ASP 57 Ca 0.05 0.11 -0.36 0.00 0.52 0.00 0.00 54.79 55.11 1bry n ASP 57 Cb 0.12 -2.85 -0.08 0.00 -0.72 0.00 0.00 41.12 37.60 1bry n ASP 57 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 1bry s GLU 58 N -3.89 4.19 -0.00 -0.67 2.02 -1.26 -4.86 118.70 114.23 1bry s GLU 58 Ca 0.00 -0.10 0.05 0.00 0.02 0.00 0.00 54.97 54.95 1bry s GLU 58 Cb 0.00 -3.45 -0.03 0.00 0.10 0.00 0.00 34.13 30.75 1bry s GLU 58 CO 0.00 0.22 -0.16 0.99 0.02 0.00 0.00 175.26 176.33 1bry s THR 59 N 0.57 2.95 0.04 3.63 2.01 -1.26 -1.01 115.64 122.56 1bry s THR 59 Ca 0.11 -0.95 0.07 0.00 0.31 0.00 0.00 61.69 61.24 1bry s THR 59 Cb -0.12 -2.20 -0.02 0.00 0.01 0.00 0.00 72.50 70.16 1bry s THR 59 CO 0.02 0.46 -0.20 0.27 -0.69 0.00 0.00 174.62 174.47 1bry s ILE 60 N -0.84 1.64 -0.16 1.82 -4.36 -0.33 -4.53 121.20 114.44 1bry s ILE 60 Ca 0.13 -1.16 -0.05 0.00 -0.26 0.00 0.00 60.65 59.32 1bry s ILE 60 Cb -0.11 -1.42 -0.03 0.00 1.25 0.00 0.00 42.46 42.15 1bry s ILE 60 CO 0.03 0.23 -0.01 -0.44 0.24 0.00 0.00 174.94 174.99 1bry s SER 61 N -1.10 4.98 -0.13 4.36 0.01 -0.44 -1.10 113.70 120.27 1bry s SER 61 Ca 0.07 -0.09 0.00 0.00 1.31 0.00 0.00 55.95 57.25 1bry s SER 61 Cb -0.09 -1.82 -0.01 0.00 0.21 0.00 0.00 66.02 64.31 1bry s SER 61 CO 0.01 0.16 -0.14 -0.69 0.41 0.00 0.00 173.24 172.99 1bry s VAL 62 N 0.41 2.89 -0.16 3.43 1.01 0.84 -0.25 120.40 128.57 1bry s VAL 62 Ca -0.02 -0.71 -0.15 0.00 0.00 0.00 0.00 61.98 61.09 1bry s VAL 62 Cb -0.14 -2.21 -0.04 0.00 0.00 0.00 0.00 36.38 33.99 1bry s VAL 62 CO 0.02 0.52 0.37 0.00 0.00 0.00 0.00 175.10 176.01 1bry s ALA 63 N 0.46 3.55 -0.03 5.51 0.00 -0.38 -1.14 121.76 129.74 1bry s ALA 63 Ca -0.10 -0.41 0.06 0.00 0.00 0.00 0.00 51.96 51.50 1bry s ALA 63 Cb -0.16 -2.52 -0.01 0.00 0.00 0.00 0.00 23.12 20.43 1bry s ALA 63 CO 0.05 -0.04 -0.20 0.08 0.00 0.00 0.00 175.76 175.65 1bry s VAL 64 N 0.75 1.60 -0.17 0.00 1.01 -0.18 -0.69 120.40 122.72 1bry s VAL 64 Ca 0.19 -0.84 -0.29 0.00 0.00 0.00 0.00 61.98 61.04 1bry s VAL 64 Cb -0.14 -1.35 -0.00 0.00 0.00 0.00 0.00 36.38 34.89 1bry s VAL 64 CO 0.07 0.45 1.07 -0.62 0.00 0.00 0.00 175.10 176.07 1bry s ASP 65 N -0.28 7.12 0.18 3.32 -1.08 -0.21 -1.26 116.67 124.46 1bry s ASP 65 Ca 0.03 1.49 0.22 0.00 -0.52 0.00 0.00 52.55 53.78 1bry s ASP 65 Cb -0.10 -2.55 0.89 0.00 -1.46 0.00 0.00 42.92 39.71 1bry s ASP 65 CO 0.01 -0.61 1.68 1.33 0.52 0.00 0.00 175.17 178.10 1bry n VAL 66 N 5.05 0.77 0.15 1.11 0.24 0.11 -0.65 118.33 125.12 1bry n VAL 66 Ca 0.11 0.14 0.05 0.00 -2.04 0.00 0.00 64.34 62.60 1bry n VAL 66 Cb 0.47 -0.99 0.05 0.00 -1.47 0.00 0.00 33.84 31.90 1bry n VAL 66 CO 0.00 0.00 0.00 0.71 -2.14 0.00 0.00 176.83 175.40 1bry h THR 67 N 0.00 0.54 0.00 3.34 1.35 -1.84 -3.40 112.91 112.90 1bry h THR 67 Ca 0.00 -1.79 0.00 0.00 -0.55 0.00 0.00 66.41 64.07 1bry h THR 67 Cb 0.41 2.22 0.00 0.00 -1.73 0.00 0.00 68.15 69.04 1bry h THR 67 CO 0.00 0.31 0.00 -0.46 -0.25 0.00 0.00 175.52 175.12 1bry n ASN 68 N -3.13 0.14 -1.75 5.36 0.23 -1.15 -4.57 115.26 110.40 1bry n ASN 68 Ca 0.01 -1.03 -0.19 0.00 -0.53 0.00 0.00 54.58 52.84 1bry n ASN 68 Cb 0.68 0.00 -0.05 0.00 -2.08 0.00 0.00 39.78 38.32 1bry n ASN 68 CO 0.00 0.00 0.00 0.52 -0.93 0.00 0.00 177.26 176.85 1bry n VAL 69 N -0.01 -0.35 -2.83 3.53 0.31 0.18 -4.98 118.33 114.18 1bry n VAL 69 Ca 0.00 0.00 -0.41 0.00 -0.01 0.00 0.00 64.34 63.92 1bry n VAL 69 Cb 0.28 -2.23 -0.05 0.00 -0.91 0.00 0.00 33.84 30.93 1bry n VAL 69 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 1bry s TYR 70 N -2.81 3.79 -0.06 3.52 2.02 -1.22 -4.71 117.35 117.88 1bry s TYR 70 Ca 0.00 1.68 -0.30 0.00 -0.37 0.00 0.00 57.07 58.08 1bry s TYR 70 Cb 0.00 -2.96 -0.02 0.00 -0.40 0.00 0.00 41.96 38.58 1bry s TYR 70 CO 0.00 0.25 1.05 0.42 -1.57 0.00 0.00 175.55 175.70 1bry s ILE 71 N -0.09 4.66 -0.14 2.71 1.01 -1.26 -1.05 121.20 127.05 1bry s ILE 71 Ca 0.43 1.93 0.04 0.00 0.00 0.00 0.00 60.65 63.05 1bry s ILE 71 Cb -0.22 -4.24 -0.23 0.00 0.01 0.00 0.00 42.46 37.78 1bry s ILE 71 CO 0.27 0.04 0.29 0.23 0.00 0.00 0.00 174.94 175.78 1bry n MET 72 N 4.74 0.69 -3.38 2.79 2.81 0.13 -4.89 117.12 120.02 1bry n MET 72 Ca 0.09 0.21 0.00 0.00 -1.81 0.00 0.00 57.70 56.19 1bry n MET 72 Cb 0.49 -1.67 0.00 0.00 -0.71 0.00 0.00 33.22 31.33 1bry n MET 72 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1bry n GLY 73 N 1.89 -1.46 3.34 3.03 0.00 -1.24 -1.96 105.19 108.78 1bry n GLY 73 Ca -0.31 -1.02 -0.10 0.00 0.00 0.00 0.00 46.02 44.60 1bry n GLY 73 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1bry s TYR 74 N -2.66 -0.01 -0.08 1.61 1.13 0.26 -1.25 117.35 116.34 1bry s TYR 74 Ca 0.00 -0.34 0.05 0.00 -1.41 0.00 0.00 57.07 55.37 1bry s TYR 74 Cb 0.00 0.17 -0.01 0.00 -1.10 0.00 0.00 41.96 41.02 1bry s TYR 74 CO 0.00 -0.71 -0.24 -1.17 -2.51 0.00 0.00 175.55 170.91 1bry s LEU 75 N -2.86 2.10 -0.26 -3.49 2.96 0.65 -0.16 118.68 117.62 1bry s LEU 75 Ca 0.07 -0.53 0.00 0.00 -0.22 0.00 0.00 54.13 53.45 1bry s LEU 75 Cb 0.02 -1.40 0.08 0.00 0.50 0.00 0.00 46.19 45.39 1bry s LEU 75 CO -0.08 0.20 0.02 0.00 -1.32 0.00 0.00 176.35 175.16 1bry s ALA 76 N 0.11 1.79 0.00 5.97 0.00 -0.23 -1.33 121.76 128.07 1bry s ALA 76 Ca -0.12 -1.47 0.00 0.00 0.00 0.00 0.00 51.96 50.37 1bry s ALA 76 Cb -0.16 -1.51 0.00 0.00 0.00 0.00 0.00 23.12 21.45 1bry s ALA 76 CO 0.07 -1.38 0.00 0.41 0.00 0.00 0.00 175.76 174.85 1bry n GLY 77 N 4.74 3.68 1.18 0.00 0.00 -1.26 -1.69 105.19 111.83 1bry n GLY 77 Ca -0.07 0.08 0.12 0.00 0.00 0.00 0.00 46.02 46.16 1bry n GLY 77 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1bry n ASP 78 N 9.36 3.52 -4.23 1.61 8.00 -1.26 -4.91 116.55 128.64 1bry n ASP 78 Ca 0.00 -2.00 -0.34 0.00 0.71 0.00 0.00 54.79 53.17 1bry n ASP 78 Cb 0.00 -0.26 -0.15 0.00 -0.02 0.00 0.00 41.12 40.69 1bry n ASP 78 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1bry s VAL 79 N -1.47 2.66 0.13 2.53 1.01 -0.68 -0.26 120.40 124.32 1bry s VAL 79 Ca 0.39 -0.75 0.01 0.00 0.00 0.00 0.00 61.98 61.63 1bry s VAL 79 Cb 0.23 -2.15 -0.04 0.00 0.00 0.00 0.00 36.38 34.42 1bry s VAL 79 CO 0.32 0.50 0.28 -0.94 0.00 0.00 0.00 175.10 175.26 1bry s SER 80 N 1.17 6.36 -0.05 3.32 1.04 -0.29 -1.07 113.70 124.18 1bry s SER 80 Ca 0.02 0.26 0.01 0.00 0.48 0.00 0.00 55.95 56.71 1bry s SER 80 Cb -0.14 -1.95 0.02 0.00 0.10 0.00 0.00 66.02 64.05 1bry s SER 80 CO -0.06 0.07 -0.03 -0.31 0.98 0.00 0.00 173.24 173.89 1bry s TYR 81 N -1.69 0.71 0.05 5.02 1.51 0.77 -0.58 117.35 123.14 1bry s TYR 81 Ca 0.36 -0.19 0.07 0.00 -1.01 0.00 0.00 57.07 56.30 1bry s TYR 81 Cb -0.12 -0.68 -0.03 0.00 -0.11 0.00 0.00 41.96 41.03 1bry s TYR 81 CO 0.28 -0.22 -0.20 -0.06 -1.11 0.00 0.00 175.55 174.25 1bry s PHE 82 N 1.13 1.73 0.61 2.71 0.08 -0.46 -0.58 117.98 123.21 1bry s PHE 82 Ca -0.08 -0.37 -0.18 0.00 0.12 0.00 0.00 56.93 56.42 1bry s PHE 82 Cb -0.14 -1.03 -0.02 0.00 -0.57 0.00 0.00 43.02 41.26 1bry s PHE 82 CO -0.01 0.09 1.20 -0.06 -0.10 0.00 0.00 175.22 176.33 1bry s PHE 83 N -0.83 2.38 -1.31 0.36 0.08 -0.83 -0.42 117.98 117.41 1bry s PHE 83 Ca 0.07 1.53 -0.15 0.00 0.12 0.00 0.00 56.93 58.50 1bry s PHE 83 Cb -0.09 -3.45 0.10 0.00 -0.57 0.00 0.00 43.02 39.02 1bry s PHE 83 CO 0.02 -2.19 1.81 -1.71 -0.10 0.00 0.00 175.22 173.05 1bry n ASN 84 N -1.78 4.78 -3.48 1.36 5.15 -0.40 -4.56 115.26 116.32 1bry n ASN 84 Ca 0.13 -2.95 -0.13 0.00 -0.60 0.00 0.00 54.58 51.04 1bry n ASN 84 Cb 0.50 -1.64 -0.04 0.00 -0.53 0.00 0.00 39.78 38.07 1bry n ASN 84 CO 0.00 0.00 0.00 -1.83 1.40 0.00 0.00 177.26 176.83 1bry s GLU 85 N 2.74 1.06 0.25 1.20 -1.05 -1.26 -4.06 118.70 117.57 1bry s GLU 85 Ca 0.47 -0.15 -0.07 0.00 -0.15 0.00 0.00 54.97 55.08 1bry s GLU 85 Cb 0.06 0.49 0.45 0.00 -0.44 0.00 0.00 34.13 34.69 1bry s GLU 85 CO 0.01 -0.41 1.64 0.00 0.95 0.00 0.00 175.26 177.44 1bry h ALA 86 N 2.37 0.81 -0.88 -0.84 0.00 -2.00 -1.43 119.26 117.30 1bry h ALA 86 Ca -0.28 0.24 0.02 0.00 0.00 0.00 0.00 54.91 54.89 1bry h ALA 86 Cb 1.23 0.41 -0.05 0.00 0.00 0.00 0.00 17.79 19.38 1bry h ALA 86 CO 0.36 -0.42 0.57 0.66 0.00 0.00 0.00 179.25 180.42 1bry h SER 87 N 0.11 0.97 0.14 0.00 4.64 -1.97 -1.80 113.55 115.63 1bry h SER 87 Ca 0.42 -0.01 -0.14 0.00 -0.47 0.00 0.00 61.79 61.58 1bry h SER 87 Cb 0.74 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 62.59 1bry h SER 87 CO -0.66 0.68 -0.52 0.00 -0.87 0.00 0.00 176.83 175.45 1bry h ALA 88 N 1.35 0.82 -0.71 5.18 0.00 -1.56 -1.60 119.26 122.74 1bry h ALA 88 Ca 0.34 -0.50 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 1bry h ALA 88 Cb -0.05 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 1bry h ALA 88 CO -0.10 0.68 0.23 1.15 0.00 0.00 0.00 179.25 181.21 1bry h THR 89 N 0.33 1.25 -0.40 0.00 2.02 -0.84 -1.21 112.91 114.06 1bry h THR 89 Ca 0.01 -0.86 -0.14 0.00 0.77 0.00 0.00 66.41 66.19 1bry h THR 89 Cb 1.03 0.47 -0.01 0.00 -1.74 0.00 0.00 68.15 67.90 1bry h THR 89 CO 0.09 0.34 -0.29 -0.08 0.37 0.00 0.00 175.52 175.95 1bry h GLU 90 N 1.04 0.91 -0.63 6.66 4.57 -1.18 -2.85 114.58 123.11 1bry h GLU 90 Ca 0.23 -0.44 0.03 0.00 -1.18 0.00 0.00 59.36 58.00 1bry h GLU 90 Cb 0.28 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.83 1bry h GLU 90 CO -0.01 1.09 0.41 0.00 -1.18 0.00 0.00 179.01 179.32 1bry h ALA 91 N 0.80 1.65 0.00 2.92 0.00 -0.77 -1.55 119.26 122.31 1bry h ALA 91 Ca 0.08 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1bry h ALA 91 Cb 0.87 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1bry h ALA 91 CO 0.08 0.29 0.00 0.00 0.00 0.00 0.00 179.25 179.62 1bry n ALA 92 N -2.45 1.23 0.70 0.00 0.00 -0.51 -0.78 120.51 118.70 1bry n ALA 92 Ca 0.07 0.12 0.13 0.00 0.00 0.00 0.00 53.44 53.76 1bry n ALA 92 Cb 0.12 -1.27 0.36 0.00 0.00 0.00 0.00 19.45 18.66 1bry n ALA 92 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1bry n LYS 93 N -2.06 0.21 -0.02 0.00 5.02 -0.58 -4.31 118.16 116.41 1bry n LYS 93 Ca 0.00 0.13 -0.03 0.00 -2.02 0.00 0.00 58.31 56.39 1bry n LYS 93 Cb 0.09 -1.70 -0.03 0.00 -0.02 0.00 0.00 35.03 33.36 1bry n LYS 93 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1bry n PHE 94 N -2.04 0.00 -4.30 2.13 3.01 0.04 -5.00 117.46 111.29 1bry n PHE 94 Ca 0.05 0.00 -0.29 0.00 1.01 0.00 0.00 57.45 58.22 1bry n PHE 94 Cb 0.41 -0.23 -0.11 0.00 -0.01 0.00 0.00 39.48 39.55 1bry n PHE 94 CO 0.00 0.00 0.00 0.14 1.01 0.00 0.00 176.76 177.91 1bry s VAL 95 N -2.11 2.90 -1.47 -4.37 -7.23 -0.73 -4.67 120.40 102.72 1bry s VAL 95 Ca -0.03 -1.54 -0.07 0.00 -1.81 0.00 0.00 61.98 58.52 1bry s VAL 95 Cb 0.01 -2.35 0.03 0.00 0.56 0.00 0.00 36.38 34.64 1bry s VAL 95 CO 0.18 0.06 0.73 0.49 -0.31 0.00 0.00 175.10 176.25 1bry n PHE 96 N 0.66 -2.14 0.29 2.82 3.72 -1.26 -4.70 117.46 116.86 1bry n PHE 96 Ca -0.15 0.64 0.18 0.00 -0.05 0.00 0.00 57.45 58.08 1bry n PHE 96 Cb 0.53 -4.22 0.88 0.00 -0.94 0.00 0.00 39.48 35.73 1bry n PHE 96 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 1bry h LYS 97 N -1.62 0.00 -0.42 -1.08 1.57 -1.86 -2.46 116.57 110.70 1bry h LYS 97 Ca -0.52 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.26 1bry h LYS 97 Cb 1.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.66 1bry h LYS 97 CO 0.57 0.04 0.00 -0.25 -0.57 0.00 0.00 179.45 179.24 1bry n ASP 98 N -3.25 2.57 -4.76 0.86 8.00 -1.26 -4.94 116.55 113.77 1bry n ASP 98 Ca -0.01 -1.94 -0.40 0.00 0.71 0.00 0.00 54.79 53.15 1bry n ASP 98 Cb 0.21 -0.27 0.02 0.00 -0.02 0.00 0.00 41.12 41.05 1bry n ASP 98 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bry s ALA 99 N -1.45 3.16 -0.50 2.24 0.00 -0.93 -4.91 121.76 119.37 1bry s ALA 99 Ca 0.34 1.46 0.24 0.00 0.00 0.00 0.00 51.96 54.00 1bry s ALA 99 Cb 0.18 -3.59 0.40 0.00 0.00 0.00 0.00 23.12 20.11 1bry s ALA 99 CO 0.25 -1.25 1.53 0.87 0.00 0.00 0.00 175.76 177.16 1bry h LYS 100 N 2.15 0.00 -2.99 0.00 1.57 -0.99 -3.45 116.57 112.87 1bry h LYS 100 Ca -0.51 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.09 1bry h LYS 100 Cb 1.27 0.00 -0.29 0.00 0.08 0.00 0.00 32.23 33.30 1bry h LYS 100 CO 0.60 0.00 -0.45 0.21 -0.57 0.00 0.00 179.45 179.25 1bry s LYS 101 N -3.20 0.25 -0.19 3.15 2.20 -0.94 -5.04 119.74 115.96 1bry s LYS 101 Ca 0.07 0.54 -0.01 0.00 -0.36 0.00 0.00 55.97 56.20 1bry s LYS 101 Cb 0.08 -0.06 -0.00 0.00 -1.51 0.00 0.00 37.83 36.34 1bry s LYS 101 CO 0.68 -0.14 -0.11 0.21 -0.36 0.00 0.00 175.35 175.62 1bry s LYS 102 N 1.09 3.26 -0.08 4.03 2.20 -1.26 -1.14 119.74 127.84 1bry s LYS 102 Ca -0.08 -0.70 -0.01 0.00 -0.36 0.00 0.00 55.97 54.82 1bry s LYS 102 Cb -0.09 -2.78 -0.03 0.00 -1.51 0.00 0.00 37.83 33.42 1bry s LYS 102 CO -0.08 -0.11 -0.03 0.08 -0.36 0.00 0.00 175.35 174.86 1bry s VAL 103 N 1.16 4.06 -0.29 4.02 1.01 0.25 -4.98 120.40 125.65 1bry s VAL 103 Ca 0.01 -0.35 -0.09 0.00 0.00 0.00 0.00 61.98 61.55 1bry s VAL 103 Cb -0.14 -2.69 -0.02 0.00 0.00 0.00 0.00 36.38 33.52 1bry s VAL 103 CO -0.04 0.60 0.14 -0.89 0.00 0.00 0.00 175.10 174.91 1bry s THR 104 N -0.86 4.72 0.64 3.92 2.01 -1.26 -1.35 115.64 123.46 1bry s THR 104 Ca 0.13 -0.19 -0.18 0.00 0.31 0.00 0.00 61.69 61.76 1bry s THR 104 Cb -0.11 -3.31 -0.01 0.00 0.01 0.00 0.00 72.50 69.07 1bry s THR 104 CO 0.02 0.19 1.25 -0.76 -0.69 0.00 0.00 174.62 174.62 1bry s LEU 105 N 1.66 3.57 0.00 4.42 1.43 0.44 -4.90 118.68 125.30 1bry s LEU 105 Ca 0.06 2.49 0.00 0.00 -1.03 0.00 0.00 54.13 55.65 1bry s LEU 105 Cb -0.16 -4.61 0.00 0.00 0.03 0.00 0.00 46.19 41.45 1bry s LEU 105 CO 0.07 -1.88 0.69 -0.81 0.23 0.00 0.00 176.35 174.65 1bry n PRO 106 N -1.91 0.94 -3.46 1.29 -0.04 -1.26 -3.71 135.00 126.86 1bry n PRO 106 Ca 0.15 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.48 1bry n PRO 106 Cb 0.49 -1.26 -0.03 0.00 -0.04 0.00 0.00 33.50 32.66 1bry n PRO 106 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1bry s TYR 107 N -0.51 -0.51 0.96 0.54 -0.85 -1.26 -5.00 117.35 110.72 1bry s TYR 107 Ca 0.00 0.45 -0.15 0.00 -0.52 0.00 0.00 57.07 56.85 1bry s TYR 107 Cb 0.00 0.53 0.21 0.00 0.38 0.00 0.00 41.96 43.08 1bry s TYR 107 CO 0.00 -0.73 1.31 -1.54 -1.52 0.00 0.00 175.55 173.08 1bry s SER 108 N -2.37 3.05 0.00 -0.18 1.04 -1.26 -1.27 113.70 112.71 1bry s SER 108 Ca -0.00 0.13 0.12 0.00 0.48 0.00 0.00 55.95 56.68 1bry s SER 108 Cb -0.01 -0.14 0.37 0.00 0.10 0.00 0.00 66.02 66.33 1bry s SER 108 CO -0.08 -2.76 1.30 0.61 0.98 0.00 0.00 173.24 173.29 1bry n GLY 109 N -3.74 0.72 3.75 7.32 0.00 -1.26 -4.51 105.19 107.46 1bry n GLY 109 Ca 0.16 -0.41 -0.41 0.00 0.00 0.00 0.00 46.02 45.36 1bry n GLY 109 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1bry s ASN 110 N -1.05 6.83 0.24 1.61 3.84 -1.26 -4.90 114.94 120.25 1bry s ASN 110 Ca 0.26 2.52 -0.05 0.00 0.21 0.00 0.00 52.86 55.80 1bry s ASN 110 Cb 0.13 -2.62 0.34 0.00 -0.55 0.00 0.00 41.25 38.55 1bry s ASN 110 CO 0.18 -0.55 1.85 1.88 -2.79 0.00 0.00 177.10 177.67 1bry h TYR 111 N 4.74 0.97 -0.42 0.43 0.05 -1.99 -0.42 116.97 120.34 1bry h TYR 111 Ca -0.46 0.03 0.01 0.00 0.05 0.00 0.00 58.73 58.36 1bry h TYR 111 Cb 1.22 -0.31 -0.02 0.00 1.01 0.00 0.00 36.73 38.62 1bry h TYR 111 CO 0.60 0.48 0.26 0.93 -1.05 0.00 0.00 178.16 179.38 1bry h GLU 112 N 0.95 0.51 -0.49 4.88 3.07 -1.98 0.10 114.58 121.62 1bry h GLU 112 Ca 0.38 -0.03 -0.05 0.00 -0.50 0.00 0.00 59.36 59.15 1bry h GLU 112 Cb 0.19 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 27.97 1bry h GLU 112 CO -0.18 0.34 0.11 0.00 -1.40 0.00 0.00 179.01 177.87 1bry h ARG 113 N 0.52 0.79 -0.45 2.33 2.47 -1.76 -1.65 114.38 116.64 1bry h ARG 113 Ca 0.16 -0.20 -0.06 0.00 -1.26 0.00 0.00 59.98 58.62 1bry h ARG 113 Cb -0.02 -0.10 -0.02 0.00 -1.65 0.00 0.00 29.97 28.18 1bry h ARG 113 CO -0.06 0.78 0.03 -0.07 0.56 0.00 0.00 179.97 181.21 1bry h LEU 114 N 0.67 0.75 -0.56 3.04 3.38 -0.85 -0.86 115.31 120.88 1bry h LEU 114 Ca 0.15 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 1bry h LEU 114 Cb 0.35 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 1bry h LEU 114 CO 0.00 0.86 0.27 1.56 0.09 0.00 0.00 178.44 181.22 1bry h GLN 115 N 0.62 0.80 -0.28 1.13 4.20 -0.69 0.18 115.11 121.08 1bry h GLN 115 Ca 0.13 -0.12 -0.01 0.00 0.06 0.00 0.00 58.65 58.72 1bry h GLN 115 Cb 0.45 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 1bry h GLN 115 CO 0.02 0.65 0.15 1.15 -0.67 0.00 0.00 178.83 180.13 1bry h THR 116 N 0.75 1.13 -0.29 -0.54 2.02 -1.16 0.21 112.91 115.02 1bry h THR 116 Ca 0.19 -0.36 -0.05 0.00 0.77 0.00 0.00 66.41 66.96 1bry h THR 116 Cb 0.11 0.86 -0.02 0.00 -1.74 0.00 0.00 68.15 67.37 1bry h THR 116 CO -0.02 0.13 -0.05 0.00 0.37 0.00 0.00 175.52 175.95 1bry h ALA 117 N 1.02 1.38 0.00 6.16 0.00 -0.87 -2.48 119.26 124.47 1bry h ALA 117 Ca 0.10 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 1bry h ALA 117 Cb 0.08 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1bry h ALA 117 CO -0.01 0.43 -0.19 0.00 0.00 0.00 0.00 179.25 179.47 1bry h ALA 118 N 1.52 0.88 -0.47 0.00 0.00 -0.25 -3.47 119.26 117.46 1bry h ALA 118 Ca 0.09 -0.17 -0.14 0.00 0.00 0.00 0.00 54.91 54.69 1bry h ALA 118 Cb 0.36 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.08 1bry h ALA 118 CO 0.02 0.23 -0.14 0.41 0.00 0.00 0.00 179.25 179.77 1bry n GLY 119 N 1.15 0.75 3.34 0.00 0.00 0.68 -4.89 105.19 106.23 1bry n GLY 119 Ca 0.03 -0.70 -0.14 0.00 0.00 0.00 0.00 46.02 45.21 1bry n GLY 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bry s LYS 120 N -2.96 0.73 0.46 1.61 1.02 -0.92 -5.04 119.74 114.64 1bry s LYS 120 Ca 0.00 0.16 -0.03 0.00 0.02 0.00 0.00 55.97 56.12 1bry s LYS 120 Cb 0.00 0.34 -0.03 0.00 -0.52 0.00 0.00 37.83 37.62 1bry s LYS 120 CO 0.00 -0.18 0.72 0.96 -0.92 0.00 0.00 175.35 175.93 1bry s ILE 121 N -0.84 4.71 0.35 2.17 -4.36 -1.26 -4.45 121.20 117.52 1bry s ILE 121 Ca -0.09 -0.08 0.09 0.00 -0.26 0.00 0.00 60.65 60.32 1bry s ILE 121 Cb -0.03 -3.77 0.33 0.00 1.25 0.00 0.00 42.46 40.23 1bry s ILE 121 CO 0.05 -0.67 1.86 0.03 0.24 0.00 0.00 174.94 176.44 1bry h ARG 122 N 0.33 0.66 0.00 0.37 3.08 -1.96 -0.26 114.38 116.60 1bry h ARG 122 Ca -0.47 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.54 1bry h ARG 122 Cb 1.22 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 31.12 1bry h ARG 122 CO 0.61 0.44 0.00 0.93 -1.07 0.00 0.00 179.97 180.88 1bry h GLU 123 N 0.68 0.00 -0.41 0.04 3.07 -1.94 -2.27 114.58 113.75 1bry h GLU 123 Ca 0.47 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.33 1bry h GLU 123 Cb 0.78 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.69 1bry h GLU 123 CO -0.22 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 177.48 1bry n ASN 124 N -2.95 3.20 -4.25 1.42 3.02 -0.11 -4.15 115.26 111.44 1bry n ASN 124 Ca -0.03 -2.08 -0.35 0.00 -0.03 0.00 0.00 54.58 52.10 1bry n ASN 124 Cb 0.06 -0.30 -0.14 0.00 -0.61 0.00 0.00 39.78 38.79 1bry n ASN 124 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1bry s ILE 125 N -1.14 3.13 0.45 2.41 1.01 -0.86 -4.94 121.20 121.26 1bry s ILE 125 Ca 0.29 -0.80 -0.25 0.00 0.00 0.00 0.00 60.65 59.89 1bry s ILE 125 Cb 0.16 -2.52 -0.09 0.00 0.01 0.00 0.00 42.46 40.02 1bry s ILE 125 CO 0.18 0.28 1.37 -2.65 0.00 0.00 0.00 174.94 174.12 1bry n PRO 126 N 4.73 2.10 -4.75 2.79 -0.02 -1.26 -4.43 135.00 134.16 1bry n PRO 126 Ca -0.17 0.75 -0.33 0.00 -2.02 0.00 0.00 63.50 61.73 1bry n PRO 126 Cb 0.49 -2.54 -0.07 0.00 -0.02 0.00 0.00 33.50 31.36 1bry n PRO 126 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1bry s LEU 127 N -2.34 2.19 0.00 2.45 1.43 0.46 -4.86 118.68 118.01 1bry s LEU 127 Ca 0.62 -1.70 0.00 0.00 -1.03 0.00 0.00 54.13 52.02 1bry s LEU 127 Cb -0.47 -0.62 0.00 0.00 0.03 0.00 0.00 46.19 45.13 1bry s LEU 127 CO 0.57 -0.92 0.00 0.61 0.23 0.00 0.00 176.35 176.85 1bry n GLY 128 N -1.25 2.77 0.24 -3.19 0.00 -1.26 -1.27 105.19 101.23 1bry n GLY 128 Ca -0.19 -2.08 -0.06 0.00 0.00 0.00 0.00 46.02 43.68 1bry n GLY 128 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1bry h LEU 129 N 0.00 0.70 -1.66 0.99 3.38 -0.97 -1.44 115.31 116.32 1bry h LEU 129 Ca 0.00 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 1bry h LEU 129 Cb 0.00 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 1bry h LEU 129 CO 0.00 0.55 -0.17 -0.65 0.09 0.00 0.00 178.44 178.26 1bry h PRO 130 N 0.80 0.00 -0.10 1.13 0.11 -1.75 -0.26 132.00 131.92 1bry h PRO 130 Ca 0.21 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.22 1bry h PRO 130 Cb -0.03 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.07 1bry h PRO 130 CO -0.04 0.17 -0.41 0.00 -0.21 0.00 0.00 178.00 177.51 1bry h ALA 131 N 1.83 1.13 -0.31 -0.75 0.00 -1.55 -1.76 119.26 117.85 1bry h ALA 131 Ca -0.00 -0.41 -0.17 0.00 0.00 0.00 0.00 54.91 54.33 1bry h ALA 131 Cb 0.31 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1bry h ALA 131 CO 0.02 0.58 -0.49 1.25 0.00 0.00 0.00 179.25 180.61 1bry h LEU 132 N 0.19 0.93 -0.47 0.00 5.85 -0.41 -0.69 115.31 120.71 1bry h LEU 132 Ca 0.02 -0.47 0.03 0.00 0.84 0.00 0.00 57.88 58.30 1bry h LEU 132 Cb 0.81 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.53 1bry h LEU 132 CO 0.06 1.26 0.25 -0.78 -0.34 0.00 0.00 178.44 178.89 1bry h ASP 133 N 0.67 0.37 -0.60 1.25 3.58 -0.91 -1.17 116.42 119.61 1bry h ASP 133 Ca 0.03 0.02 -0.03 0.00 0.42 0.00 0.00 57.03 57.47 1bry h ASP 133 Cb 1.08 -0.05 -0.03 0.00 1.72 0.00 0.00 39.33 42.05 1bry h ASP 133 CO 0.11 0.26 0.26 0.28 -2.88 0.00 0.00 179.24 177.28 1bry h SER 134 N 0.50 0.81 -0.92 2.28 0.02 -1.08 -1.74 113.55 113.41 1bry h SER 134 Ca 0.20 -0.15 -0.00 0.00 -0.84 0.00 0.00 61.79 61.00 1bry h SER 134 Cb 0.08 -0.21 -0.04 0.00 0.14 0.00 0.00 62.40 62.37 1bry h SER 134 CO -0.13 0.74 0.56 0.00 -1.14 0.00 0.00 176.83 176.86 1bry h ALA 135 N 1.10 1.17 -0.25 3.77 0.00 -0.80 -0.62 119.26 123.64 1bry h ALA 135 Ca 0.20 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1bry h ALA 135 Cb 0.16 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1bry h ALA 135 CO -0.02 0.62 0.06 0.82 0.00 0.00 0.00 179.25 180.73 1bry h ILE 136 N 1.26 1.21 -0.29 0.00 2.04 -0.81 -1.20 117.51 119.72 1bry h ILE 136 Ca 0.33 -0.69 0.05 0.00 1.00 0.00 0.00 64.86 65.55 1bry h ILE 136 Cb -0.07 1.19 -0.04 0.00 -0.74 0.00 0.00 36.82 37.16 1bry h ILE 136 CO -0.06 0.22 0.01 0.74 0.00 0.00 0.00 178.15 179.05 1bry h THR 137 N 0.23 0.80 -0.40 -0.27 2.02 -1.01 0.28 112.91 114.55 1bry h THR 137 Ca 0.08 -0.03 0.05 0.00 0.77 0.00 0.00 66.41 67.28 1bry h THR 137 Cb 0.28 0.70 -0.05 0.00 -1.74 0.00 0.00 68.15 67.34 1bry h THR 137 CO 0.00 0.02 0.13 0.74 0.37 0.00 0.00 175.52 176.78 1bry h THR 138 N 0.09 0.86 -0.03 3.16 2.02 -0.89 -2.88 112.91 115.24 1bry h THR 138 Ca 0.14 -0.10 -0.23 0.00 0.77 0.00 0.00 66.41 66.99 1bry h THR 138 Cb 0.18 0.55 0.01 0.00 -1.74 0.00 0.00 68.15 67.15 1bry h THR 138 CO -0.23 0.05 -0.93 -0.07 0.37 0.00 0.00 175.52 174.72 1bry h LEU 139 N 0.28 0.71 -0.14 2.58 3.38 -0.96 0.24 115.31 121.39 1bry h LEU 139 Ca 0.19 -0.54 0.03 0.00 0.09 0.00 0.00 57.88 57.65 1bry h LEU 139 Cb 0.19 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 1bry h LEU 139 CO -0.20 1.33 -0.07 0.22 0.09 0.00 0.00 178.44 179.80 1bry h TYR 140 N 0.33 -0.18 0.00 1.13 3.20 -0.37 -2.82 116.97 118.27 1bry h TYR 140 Ca -0.09 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.80 1bry h TYR 140 Cb 1.56 0.10 0.00 0.00 1.54 0.00 0.00 36.73 39.93 1bry h TYR 140 CO 0.08 -0.12 -0.82 1.88 -1.64 0.00 0.00 178.16 177.54 1bry h TYR 141 N -0.06 0.00 -4.73 -3.82 0.05 -1.62 -3.46 116.97 103.33 1bry h TYR 141 Ca 0.08 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.86 1bry h TYR 141 Cb 0.19 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.93 1bry h TYR 141 CO -0.21 0.00 -0.20 0.98 -1.05 0.00 0.00 178.16 177.67 1bry n TYR 142 N -2.69 -2.43 -2.84 4.88 9.36 -0.00 -4.96 117.16 118.47 1bry n TYR 142 Ca 0.01 0.96 -0.43 0.00 3.32 0.00 0.00 57.90 61.76 1bry n TYR 142 Cb 0.54 -3.44 -0.04 0.00 -0.63 0.00 0.00 39.34 35.77 1bry n TYR 142 CO 0.00 0.00 0.00 0.99 0.22 0.00 0.00 176.86 178.07 1bry s THR 143 N -2.56 4.29 0.27 2.97 2.01 -0.75 -4.93 115.64 116.94 1bry s THR 143 Ca 0.10 -0.28 -0.01 0.00 0.31 0.00 0.00 61.69 61.81 1bry s THR 143 Cb -0.03 -4.69 0.27 0.00 0.01 0.00 0.00 72.50 68.06 1bry s THR 143 CO 0.57 -1.46 1.68 0.00 -0.69 0.00 0.00 174.62 174.72 1bry h ALA 144 N 9.58 1.14 0.00 7.40 0.00 -1.93 -1.53 119.26 133.92 1bry h ALA 144 Ca -0.29 0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1bry h ALA 144 Cb 1.07 0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1bry h ALA 144 CO 1.18 -0.36 0.00 0.66 0.00 0.00 0.00 179.25 180.73 1bry h SER 145 N 0.29 0.00 -0.00 0.00 4.64 -1.99 -2.89 113.55 113.59 1bry h SER 145 Ca 0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.80 1bry h SER 145 Cb 0.88 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.97 1bry h SER 145 CO -0.55 0.00 -0.36 -1.20 -0.87 0.00 0.00 176.83 173.85 1bry n SER 146 N -2.59 0.98 -0.20 4.97 7.64 -0.64 -4.76 113.62 119.03 1bry n SER 146 Ca 0.01 -0.99 -0.02 0.00 1.01 0.00 0.00 58.87 58.87 1bry n SER 146 Cb 0.21 0.70 0.08 0.00 -1.01 0.00 0.00 64.21 64.18 1bry n SER 146 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1bry h ALA 147 N 1.84 0.76 -0.49 -0.43 0.00 -1.16 -1.43 119.26 118.34 1bry h ALA 147 Ca 0.00 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1bry h ALA 147 Cb 0.34 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1bry h ALA 147 CO 0.00 -0.07 0.28 0.00 0.00 0.00 0.00 179.25 179.46 1bry h ALA 148 N 1.33 0.62 -0.57 0.00 0.00 -1.86 0.31 119.26 119.09 1bry h ALA 148 Ca 0.27 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 1bry h ALA 148 Cb 0.20 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1bry h ALA 148 CO -0.20 0.13 0.01 0.66 0.00 0.00 0.00 179.25 179.85 1bry h SER 149 N 0.64 0.95 -0.61 0.00 4.64 -1.79 -1.94 113.55 115.44 1bry h SER 149 Ca 0.17 -0.25 -0.04 0.00 -0.47 0.00 0.00 61.79 61.20 1bry h SER 149 Cb 0.03 -0.25 -0.03 0.00 -0.31 0.00 0.00 62.40 61.84 1bry h SER 149 CO -0.03 1.00 0.23 0.00 -0.87 0.00 0.00 176.83 177.16 1bry h ALA 150 N 1.10 1.19 -0.25 5.18 0.00 -0.80 -1.61 119.26 124.07 1bry h ALA 150 Ca 0.17 -0.18 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 1bry h ALA 150 Cb 0.51 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1bry h ALA 150 CO 0.03 0.58 -0.28 -0.07 0.00 0.00 0.00 179.25 179.50 1bry h LEU 151 N 0.94 0.50 -0.65 0.00 3.38 -0.63 0.71 115.31 119.56 1bry h LEU 151 Ca 0.22 -0.18 -0.10 0.00 0.09 0.00 0.00 57.88 57.90 1bry h LEU 151 Cb 0.22 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 1bry h LEU 151 CO -0.01 0.77 -0.04 -0.07 0.09 0.00 0.00 178.44 179.18 1bry h LEU 152 N 0.43 1.00 -0.19 1.67 3.38 -0.93 0.03 115.31 120.70 1bry h LEU 152 Ca 0.06 -0.30 -0.02 0.00 0.09 0.00 0.00 57.88 57.71 1bry h LEU 152 Cb 0.71 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 1bry h LEU 152 CO 0.05 1.07 0.03 0.58 0.09 0.00 0.00 178.44 180.27 1bry h VAL 153 N 0.92 1.22 -0.04 1.22 2.07 -0.94 -2.46 116.25 118.25 1bry h VAL 153 Ca 0.16 -0.72 0.02 0.00 0.82 0.00 0.00 66.70 66.98 1bry h VAL 153 Cb 0.59 1.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.66 1bry h VAL 153 CO 0.04 0.22 -0.07 0.25 0.02 0.00 0.00 177.57 178.03 1bry h LEU 154 N 0.12 -0.20 0.03 2.57 5.85 -0.62 -1.07 115.31 121.99 1bry h LEU 154 Ca 0.06 0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.83 1bry h LEU 154 Cb 0.30 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 1bry h LEU 154 CO 0.00 -0.10 -0.10 0.40 -0.34 0.00 0.00 178.44 178.31 1bry h ILE 155 N -0.10 0.76 -0.47 4.05 2.04 -1.02 -2.20 117.51 120.57 1bry h ILE 155 Ca 0.04 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.85 1bry h ILE 155 Cb 0.16 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 36.98 1bry h ILE 155 CO -0.10 0.00 0.07 1.56 0.00 0.00 0.00 178.15 179.69 1bry h GLN 156 N -0.18 0.73 0.00 2.37 4.20 -1.35 -1.03 115.11 119.85 1bry h GLN 156 Ca 0.03 -0.16 0.00 0.00 0.06 0.00 0.00 58.65 58.58 1bry h GLN 156 Cb 0.21 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 27.88 1bry h GLN 156 CO -0.08 0.69 0.00 0.43 -0.67 0.00 0.00 178.83 179.21 1bry n SER 157 N -4.27 0.00 0.00 1.46 7.64 -0.41 -2.26 113.62 115.78 1bry n SER 157 Ca 0.03 0.19 0.00 0.00 1.01 0.00 0.00 58.87 60.10 1bry n SER 157 Cb 0.24 -0.38 0.00 0.00 -1.01 0.00 0.00 64.21 63.06 1bry n SER 157 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1bry n THR 158 N -1.38 0.00 -0.08 0.44 -2.24 -0.85 -4.67 114.28 105.51 1bry n THR 158 Ca 0.08 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.79 1bry n THR 158 Cb 0.21 -0.57 -0.00 0.00 -2.10 0.00 0.00 70.33 67.87 1bry n THR 158 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bry h ALA 159 N 0.00 0.34 -0.43 6.98 0.00 -1.41 -1.00 119.26 123.74 1bry h ALA 159 Ca 0.00 0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 1bry h ALA 159 Cb 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1bry h ALA 159 CO 0.00 -0.29 -0.15 0.93 0.00 0.00 0.00 179.25 179.74 1bry h GLU 160 N 0.24 0.86 -0.78 0.00 4.39 -1.47 -0.82 114.58 117.01 1bry h GLU 160 Ca 0.13 -0.35 -0.02 0.00 0.34 0.00 0.00 59.36 59.46 1bry h GLU 160 Cb 0.10 -0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 28.67 1bry h GLU 160 CO -0.13 0.99 0.41 0.77 -1.16 0.00 0.00 179.01 179.89 1bry h SER 161 N 0.69 0.98 -0.27 1.42 0.02 -1.37 -1.55 113.55 113.47 1bry h SER 161 Ca 0.10 -0.09 -0.05 0.00 -0.84 0.00 0.00 61.79 60.92 1bry h SER 161 Cb 0.70 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.97 1bry h SER 161 CO 0.05 0.80 0.03 0.00 -1.14 0.00 0.00 176.83 176.57 1bry h ALA 162 N 1.35 1.36 0.00 3.77 0.00 -0.74 -3.00 119.26 122.00 1bry h ALA 162 Ca 0.27 -0.20 -0.14 0.00 0.00 0.00 0.00 54.91 54.85 1bry h ALA 162 Cb 0.05 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1bry h ALA 162 CO -0.04 0.45 -0.70 0.00 0.00 0.00 0.00 179.25 178.96 1bry h ARG 163 N 0.55 0.00 -3.62 0.00 3.08 -0.59 -3.40 114.38 110.40 1bry h ARG 163 Ca 0.12 0.00 -0.42 0.00 0.07 0.00 0.00 59.98 59.75 1bry h ARG 163 Cb 0.31 0.00 -0.38 0.00 0.08 0.00 0.00 29.97 29.98 1bry h ARG 163 CO 0.01 0.65 -0.76 0.71 -1.07 0.00 0.00 179.97 179.51 1bry s TYR 164 N -2.88 0.53 0.36 3.04 2.02 -0.64 -0.05 117.35 119.73 1bry s TYR 164 Ca 0.03 -0.07 0.07 0.00 -0.37 0.00 0.00 57.07 56.72 1bry s TYR 164 Cb 0.08 -0.72 0.76 0.00 -0.40 0.00 0.00 41.96 41.68 1bry s TYR 164 CO 0.77 -0.29 1.92 -0.22 -1.57 0.00 0.00 175.55 176.16 1bry h LYS 165 N 8.32 0.73 -0.58 -0.62 3.64 -1.30 -1.60 116.57 125.16 1bry h LYS 165 Ca -0.18 -0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.20 1bry h LYS 165 Cb 1.12 -0.16 -0.05 0.00 -0.41 0.00 0.00 32.23 32.73 1bry h LYS 165 CO 0.24 0.48 0.32 0.35 -2.27 0.00 0.00 179.45 178.57 1bry h PHE 166 N 0.75 0.58 -0.27 1.91 3.57 -1.87 -0.55 116.94 121.06 1bry h PHE 166 Ca 0.37 0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.76 1bry h PHE 166 Cb 0.43 -0.18 -0.00 0.00 2.79 0.00 0.00 35.95 38.99 1bry h PHE 166 CO -0.00 0.29 -0.35 0.82 -2.23 0.00 0.00 178.31 176.84 1bry h ILE 167 N 0.60 1.31 -0.35 1.41 2.04 -1.64 -1.71 117.51 119.17 1bry h ILE 167 Ca 0.26 -1.54 0.07 0.00 1.00 0.00 0.00 64.86 64.65 1bry h ILE 167 Cb 0.14 1.66 -0.06 0.00 -0.74 0.00 0.00 36.82 37.82 1bry h ILE 167 CO -0.16 0.49 -0.07 -0.08 0.00 0.00 0.00 178.15 178.33 1bry h GLU 168 N 0.44 0.02 -0.38 2.37 4.81 -1.02 -1.72 114.58 119.10 1bry h GLU 168 Ca 0.03 -0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.27 1bry h GLU 168 Cb 0.93 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.29 1bry h GLU 168 CO 0.08 0.01 0.25 1.96 -0.73 0.00 0.00 179.01 180.58 1bry h GLN 169 N 0.02 0.49 0.08 1.92 4.20 -0.99 -0.98 115.11 119.85 1bry h GLN 169 Ca 0.17 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.85 1bry h GLN 169 Cb 0.26 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 27.92 1bry h GLN 169 CO -0.35 0.32 -0.06 1.96 -0.67 0.00 0.00 178.83 180.04 1bry h GLN 170 N 0.50 -0.14 -0.14 1.46 1.08 -0.94 -2.08 115.11 114.85 1bry h GLN 170 Ca 0.14 0.01 -0.02 0.00 -1.45 0.00 0.00 58.65 57.32 1bry h GLN 170 Cb -0.05 0.03 -0.00 0.00 -0.05 0.00 0.00 27.48 27.41 1bry h GLN 170 CO -0.03 -0.09 -0.01 0.82 -0.95 0.00 0.00 178.83 178.56 1bry h ILE 171 N -0.15 1.26 0.00 2.54 2.04 -1.28 -3.16 117.51 118.76 1bry h ILE 171 Ca -0.00 -0.87 -0.01 0.00 1.00 0.00 0.00 64.86 64.97 1bry h ILE 171 Cb 0.13 1.57 -0.00 0.00 -0.74 0.00 0.00 36.82 37.78 1bry h ILE 171 CO -0.00 0.25 -0.04 1.23 0.00 0.00 0.00 178.15 179.59 1bry h GLY 172 N -0.03 0.00 2.00 5.37 0.00 -1.12 -2.04 103.07 107.25 1bry h GLY 172 Ca 0.04 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.31 1bry h GLY 172 CO 0.01 0.00 -0.28 0.50 0.00 0.00 0.00 176.54 176.77 1bry h LYS 173 N 0.00 0.00 -4.47 4.80 1.57 -1.34 -3.36 116.57 113.78 1bry h LYS 173 Ca -0.00 0.00 -0.74 0.00 -1.87 0.00 0.00 60.65 58.04 1bry h LYS 173 Cb 0.15 0.00 -0.21 0.00 0.08 0.00 0.00 32.23 32.24 1bry h LYS 173 CO 0.01 0.28 0.69 1.03 -0.57 0.00 0.00 179.45 180.88 1bry s ARG 174 N -3.56 3.77 -0.08 3.15 3.00 -0.77 -4.83 118.95 119.63 1bry s ARG 174 Ca 0.01 -2.30 -0.19 0.00 0.00 0.00 0.00 55.73 53.25 1bry s ARG 174 Cb 0.10 -4.77 -0.29 0.00 0.00 0.00 0.00 34.95 29.99 1bry s ARG 174 CO 0.66 -1.57 0.71 0.28 0.00 0.00 0.00 175.30 175.37 1bry h VAL 175 N 5.05 1.28 0.00 3.52 2.07 -1.82 0.69 116.25 127.03 1bry h VAL 175 Ca 0.18 -2.46 -0.00 0.00 0.82 0.00 0.00 66.70 65.24 1bry h VAL 175 Cb 0.98 2.94 -0.01 0.00 -1.52 0.00 0.00 31.29 33.69 1bry h VAL 175 CO 1.03 0.69 -0.21 -0.90 0.02 0.00 0.00 177.57 178.19 1bry n ASP 176 N -4.06 2.00 -3.94 0.57 5.68 -1.26 -4.21 116.55 111.33 1bry n ASP 176 Ca -0.20 -3.29 -0.08 0.00 -0.50 0.00 0.00 54.79 50.72 1bry n ASP 176 Cb 0.84 -0.45 -0.04 0.00 -1.14 0.00 0.00 41.12 40.33 1bry n ASP 176 CO 0.00 0.00 0.00 -1.59 -1.33 0.00 0.00 177.20 174.28 1bry s LYS 177 N -2.80 1.65 0.39 0.11 -2.85 -1.26 -5.02 119.74 109.96 1bry s LYS 177 Ca 0.33 -1.14 0.07 0.00 -1.00 0.00 0.00 55.97 54.22 1bry s LYS 177 Cb 0.30 0.53 -0.08 0.00 -2.06 0.00 0.00 37.83 36.52 1bry s LYS 177 CO -0.01 -0.72 0.01 0.95 0.10 0.00 0.00 175.35 175.69 1bry s THR 178 N -3.98 1.88 0.03 3.79 -4.23 -1.26 -4.41 115.64 107.45 1bry s THR 178 Ca 0.18 -2.01 -0.12 0.00 -1.18 0.00 0.00 61.69 58.56 1bry s THR 178 Cb -0.03 -2.95 0.02 0.00 1.34 0.00 0.00 72.50 70.87 1bry s THR 178 CO 0.08 -0.01 0.27 0.72 -0.54 0.00 0.00 174.62 175.14 1bry s PHE 179 N -2.80 -0.07 -0.13 3.99 -0.71 -0.39 -4.93 117.98 112.94 1bry s PHE 179 Ca 0.35 -0.05 -0.23 0.00 -1.04 0.00 0.00 56.93 55.96 1bry s PHE 179 Cb 0.10 0.05 -0.03 0.00 -1.21 0.00 0.00 43.02 41.93 1bry s PHE 179 CO 0.18 -0.45 0.70 -0.51 -1.34 0.00 0.00 175.22 173.80 1bry s LEU 180 N -1.90 4.23 0.50 -1.99 1.43 -1.26 -0.40 118.68 119.29 1bry s LEU 180 Ca -0.07 1.07 -0.22 0.00 -1.03 0.00 0.00 54.13 53.87 1bry s LEU 180 Cb -0.02 -3.05 -0.06 0.00 0.03 0.00 0.00 46.19 43.09 1bry s LEU 180 CO -0.02 -0.22 1.27 -2.16 0.23 0.00 0.00 176.35 175.45 1bry s PRO 181 N 1.43 3.45 0.77 1.29 0.04 -1.26 -4.99 135.00 135.73 1bry s PRO 181 Ca 0.35 2.04 -0.11 0.00 0.04 0.00 0.00 61.00 63.32 1bry s PRO 181 Cb -0.17 -2.35 0.06 0.00 0.04 0.00 0.00 34.50 32.09 1bry s PRO 181 CO 0.14 -0.88 1.13 -1.54 0.04 0.00 0.00 177.00 175.89 1bry s SER 182 N -1.11 4.74 0.38 6.66 1.04 -1.26 -4.67 113.70 119.48 1bry s SER 182 Ca 0.67 0.77 0.08 0.00 0.48 0.00 0.00 55.95 57.96 1bry s SER 182 Cb -0.35 -1.35 0.75 0.00 0.10 0.00 0.00 66.02 65.16 1bry s SER 182 CO 0.42 -1.74 1.91 -0.07 0.98 0.00 0.00 173.24 174.75 1bry h LEU 183 N -0.88 0.28 -0.56 2.42 3.38 -1.95 -2.16 115.31 115.83 1bry h LEU 183 Ca -0.46 -0.05 0.01 0.00 0.09 0.00 0.00 57.88 57.47 1bry h LEU 183 Cb 1.31 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.96 1bry h LEU 183 CO 0.64 0.42 0.36 0.00 0.09 0.00 0.00 178.44 179.95 1bry h ALA 184 N 1.62 0.71 0.10 1.53 0.00 -1.77 0.17 119.26 121.63 1bry h ALA 184 Ca 0.06 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1bry h ALA 184 Cb 0.36 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1bry h ALA 184 CO 0.02 0.11 -0.05 1.15 0.00 0.00 0.00 179.25 180.48 1bry h THR 185 N 0.72 0.96 -0.34 0.00 2.02 -1.72 -2.14 112.91 112.41 1bry h THR 185 Ca 0.21 -0.25 -0.02 0.00 0.77 0.00 0.00 66.41 67.13 1bry h THR 185 Cb -0.04 1.12 -0.02 0.00 -1.74 0.00 0.00 68.15 67.48 1bry h THR 185 CO -0.07 0.06 0.13 0.40 0.37 0.00 0.00 175.52 176.42 1bry h ILE 186 N -0.25 1.13 -0.46 3.11 1.08 -1.23 -2.37 117.51 118.51 1bry h ILE 186 Ca -0.01 -0.41 -0.06 0.00 -0.39 0.00 0.00 64.86 63.98 1bry h ILE 186 Cb 0.21 0.73 -0.02 0.00 -3.07 0.00 0.00 36.82 34.67 1bry h ILE 186 CO 0.02 0.16 0.05 -1.28 -0.69 0.00 0.00 178.15 176.41 1bry h SER 187 N 0.47 0.75 -0.38 1.72 0.87 -0.42 -0.89 113.55 115.67 1bry h SER 187 Ca 0.12 -0.28 0.00 0.00 -1.23 0.00 0.00 61.79 60.40 1bry h SER 187 Cb 0.10 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 61.84 1bry h SER 187 CO -0.01 0.84 0.24 -0.07 -0.53 0.00 0.00 176.83 177.30 1bry h LEU 188 N 0.64 0.45 -0.43 2.23 3.38 -1.01 -1.88 115.31 118.69 1bry h LEU 188 Ca 0.14 -0.03 0.03 0.00 0.09 0.00 0.00 57.88 58.11 1bry h LEU 188 Cb 0.42 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 1bry h LEU 188 CO 0.01 0.34 0.23 -0.33 0.09 0.00 0.00 178.44 178.78 1bry h GLU 189 N 0.51 0.44 0.00 1.13 5.08 -1.05 -2.57 114.58 118.12 1bry h GLU 189 Ca 0.14 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.45 1bry h GLU 189 Cb -0.03 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.12 1bry h GLU 189 CO -0.03 0.29 -0.12 -0.91 -1.00 0.00 0.00 179.01 177.24 1bry h ASN 190 N 0.45 0.00 -0.40 1.42 2.35 -0.96 -3.10 115.58 115.35 1bry h ASN 190 Ca 0.18 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.93 1bry h ASN 190 Cb 0.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.44 1bry h ASN 190 CO -0.11 0.12 0.00 0.59 -1.65 0.00 0.00 177.43 176.38 1bry n ASN 191 N -3.42 4.05 -0.07 5.81 3.02 -0.72 -4.66 115.26 119.26 1bry n ASN 191 Ca -0.01 -2.65 -0.09 0.00 -0.03 0.00 0.00 54.58 51.79 1bry n ASN 191 Cb 0.29 -0.49 -0.02 0.00 -0.61 0.00 0.00 39.78 38.94 1bry n ASN 191 CO 0.00 0.00 0.00 -0.25 -2.62 0.00 0.00 177.26 174.39 1bry h TRP 192 N 2.57 0.34 -0.29 3.10 7.01 -1.41 -0.09 115.95 127.19 1bry h TRP 192 Ca 0.00 0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.00 1bry h TRP 192 Cb 1.34 -0.12 -0.01 0.00 -2.10 0.00 0.00 29.16 28.27 1bry h TRP 192 CO 0.56 0.21 0.13 1.03 -2.79 0.00 0.00 178.44 177.58 1bry h SER 193 N 0.37 0.38 -0.28 2.65 0.87 -1.86 -0.18 113.55 115.50 1bry h SER 193 Ca 0.10 -0.14 0.00 0.00 -1.23 0.00 0.00 61.79 60.52 1bry h SER 193 Cb -0.04 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 61.81 1bry h SER 193 CO -0.02 0.42 0.18 0.00 -0.53 0.00 0.00 176.83 176.88 1bry h ALA 194 N 0.98 0.36 -0.39 6.23 0.00 -1.82 -0.83 119.26 123.79 1bry h ALA 194 Ca 0.10 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1bry h ALA 194 Cb 0.14 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1bry h ALA 194 CO -0.01 -0.15 0.12 -0.07 0.00 0.00 0.00 179.25 179.14 1bry h LEU 195 N 0.37 0.57 -0.72 0.00 3.38 -0.99 -2.10 115.31 115.84 1bry h LEU 195 Ca 0.10 -0.21 0.06 0.00 0.09 0.00 0.00 57.88 57.92 1bry h LEU 195 Cb -0.02 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 40.53 1bry h LEU 195 CO -0.02 0.63 0.42 0.28 0.09 0.00 0.00 178.44 179.83 1bry h SER 196 N 0.49 0.64 -0.22 -0.43 0.02 -0.70 -0.55 113.55 112.79 1bry h SER 196 Ca 0.13 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.08 1bry h SER 196 Cb 0.26 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.69 1bry h SER 196 CO -0.00 0.41 0.06 0.50 -1.14 0.00 0.00 176.83 176.66 1bry h LYS 197 N 0.77 0.34 -0.08 3.45 3.64 -1.02 -2.53 116.57 121.14 1bry h LYS 197 Ca 0.32 -0.07 -0.11 0.00 -1.27 0.00 0.00 60.65 59.51 1bry h LYS 197 Cb 0.17 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.93 1bry h LYS 197 CO -0.17 0.44 -0.46 1.96 -2.27 0.00 0.00 179.45 178.94 1bry h GLN 198 N 0.17 0.19 -0.44 1.90 1.08 -1.08 -1.36 115.11 115.57 1bry h GLN 198 Ca 0.07 -0.10 -0.07 0.00 -1.45 0.00 0.00 58.65 57.10 1bry h GLN 198 Cb 0.24 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.66 1bry h GLN 198 CO -0.00 0.62 -0.01 0.82 -0.95 0.00 0.00 178.83 179.30 1bry h ILE 199 N 0.15 1.26 -0.66 2.54 2.04 -1.00 0.14 117.51 121.98 1bry h ILE 199 Ca 0.01 -1.07 -0.07 0.00 1.00 0.00 0.00 64.86 64.73 1bry h ILE 199 Cb 0.88 1.07 -0.03 0.00 -0.74 0.00 0.00 36.82 38.01 1bry h ILE 199 CO 0.07 0.37 0.13 1.56 0.00 0.00 0.00 178.15 180.28 1bry h GLN 200 N 0.63 1.08 -0.39 2.37 4.20 -1.28 -2.18 115.11 119.54 1bry h GLN 200 Ca 0.12 -0.28 -0.00 0.00 0.06 0.00 0.00 58.65 58.55 1bry h GLN 200 Cb 0.51 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.14 1bry h GLN 200 CO 0.03 0.98 0.23 0.82 -0.67 0.00 0.00 178.83 180.22 1bry h ILE 201 N 1.00 1.13 -0.99 2.54 2.04 -0.94 -2.74 117.51 119.55 1bry h ILE 201 Ca 0.20 -0.30 0.10 0.00 1.00 0.00 0.00 64.86 65.86 1bry h ILE 201 Cb 0.41 0.62 -0.08 0.00 -0.74 0.00 0.00 36.82 37.03 1bry h ILE 201 CO 0.01 0.13 0.63 0.00 0.00 0.00 0.00 178.15 178.92 1bry h ALA 202 N 1.10 1.50 -0.10 1.87 0.00 -0.46 -1.90 119.26 121.26 1bry h ALA 202 Ca 0.14 0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.08 1bry h ALA 202 Cb 0.01 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 1bry h ALA 202 CO -0.03 0.29 0.12 0.66 0.00 0.00 0.00 179.25 180.29 1bry h SER 203 N 1.05 0.00 -0.11 0.00 4.64 -1.07 0.94 113.55 118.99 1bry h SER 203 Ca 0.47 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.70 1bry h SER 203 Cb 0.38 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.39 1bry h SER 203 CO -0.22 0.00 -0.56 0.35 -0.87 0.00 0.00 176.83 175.52 1bry n THR 204 N -3.80 2.19 -2.58 2.95 -2.24 -0.75 -4.63 114.28 105.42 1bry n THR 204 Ca -0.00 -3.33 -0.00 0.00 -2.27 0.00 0.00 64.05 58.45 1bry n THR 204 Cb 0.22 -0.33 0.04 0.00 -2.10 0.00 0.00 70.33 68.16 1bry n THR 204 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1bry n ASN 205 N -1.01 0.40 -3.19 3.42 5.15 -0.17 -4.99 115.26 114.87 1bry n ASN 205 Ca 0.22 -2.05 -0.23 0.00 -0.60 0.00 0.00 54.58 51.92 1bry n ASN 205 Cb 0.74 -0.07 0.03 0.00 -0.53 0.00 0.00 39.78 39.95 1bry n ASN 205 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1bry n ASN 206 N -0.39 -5.35 0.00 1.20 5.15 -1.17 -2.05 115.26 112.65 1bry n ASN 206 Ca -0.04 -0.35 0.00 0.00 -0.60 0.00 0.00 54.58 53.60 1bry n ASN 206 Cb 0.90 -4.34 0.00 0.00 -0.53 0.00 0.00 39.78 35.81 1bry n ASN 206 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1bry n GLY 207 N -1.45 0.97 3.82 8.20 0.00 0.15 -5.02 105.19 111.86 1bry n GLY 207 Ca -0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.58 1bry n GLY 207 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1bry s GLN 208 N -0.02 3.80 0.56 1.61 -1.52 -0.87 -0.70 119.66 122.52 1bry s GLN 208 Ca 0.00 -0.02 -0.17 0.00 -1.95 0.00 0.00 55.36 53.22 1bry s GLN 208 Cb 0.00 -3.28 -0.05 0.00 -0.22 0.00 0.00 33.01 29.46 1bry s GLN 208 CO 0.00 0.58 1.06 -0.06 -0.25 0.00 0.00 175.29 176.62 1bry s PHE 209 N -0.52 2.95 -0.04 0.91 0.40 -0.37 -3.78 117.98 117.53 1bry s PHE 209 Ca 0.15 1.54 0.12 0.00 -0.60 0.00 0.00 56.93 58.14 1bry s PHE 209 Cb -0.13 -3.05 -0.14 0.00 0.51 0.00 0.00 43.02 40.21 1bry s PHE 209 CO 0.04 -1.08 1.04 0.93 0.70 0.00 0.00 175.22 176.85 1bry h GLU 210 N 0.83 0.00 -3.97 0.44 5.08 -1.88 -3.46 114.58 111.62 1bry h GLU 210 Ca -0.48 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 57.66 1bry h GLU 210 Cb 1.22 0.00 -0.25 0.00 0.50 0.00 0.00 28.75 30.22 1bry h GLU 210 CO 0.58 0.59 -0.72 -1.12 -1.00 0.00 0.00 179.01 177.34 1bry s SER 211 N -6.27 0.24 0.59 1.42 0.01 -1.26 -5.15 113.70 103.28 1bry s SER 211 Ca -0.01 -0.24 -0.17 0.00 1.31 0.00 0.00 55.95 56.84 1bry s SER 211 Cb 0.09 0.03 -0.03 0.00 0.21 0.00 0.00 66.02 66.31 1bry s SER 211 CO 0.80 -0.11 1.11 -2.16 0.41 0.00 0.00 173.24 173.29 1bry s PRO 212 N -0.67 3.15 -0.13 12.44 0.04 -1.26 -4.92 135.00 143.66 1bry s PRO 212 Ca -0.06 1.45 0.02 0.00 0.04 0.00 0.00 61.00 62.45 1bry s PRO 212 Cb -0.05 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.50 1bry s PRO 212 CO -0.00 -0.98 -0.21 0.08 0.04 0.00 0.00 177.00 175.93 1bry s VAL 213 N -2.11 2.25 -0.24 -0.36 1.01 -0.53 -4.94 120.40 115.48 1bry s VAL 213 Ca 0.69 -0.93 -0.11 0.00 0.00 0.00 0.00 61.98 61.63 1bry s VAL 213 Cb -0.21 -1.90 -0.05 0.00 0.00 0.00 0.00 36.38 34.22 1bry s VAL 213 CO 0.34 0.54 0.20 -0.69 0.00 0.00 0.00 175.10 175.49 1bry s VAL 214 N 0.67 5.33 0.29 2.92 1.01 -1.26 0.16 120.40 129.52 1bry s VAL 214 Ca -0.10 0.26 0.11 0.00 0.00 0.00 0.00 61.98 62.25 1bry s VAL 214 Cb -0.16 -3.54 -0.05 0.00 0.00 0.00 0.00 36.38 32.63 1bry s VAL 214 CO 0.02 0.33 -0.11 -0.76 0.00 0.00 0.00 175.10 174.58 1bry s LEU 215 N 1.13 2.83 -0.18 3.92 1.43 -0.13 -4.94 118.68 122.74 1bry s LEU 215 Ca 0.09 -0.93 -0.07 0.00 -1.03 0.00 0.00 54.13 52.19 1bry s LEU 215 Cb -0.14 -1.30 -0.04 0.00 0.03 0.00 0.00 46.19 44.74 1bry s LEU 215 CO 0.05 -0.03 0.07 -0.63 0.23 0.00 0.00 176.35 176.04 1bry s ILE 216 N -2.47 4.83 0.32 -0.59 -1.09 -1.26 -0.44 121.20 120.51 1bry s ILE 216 Ca 0.31 -0.02 -0.02 0.00 -2.23 0.00 0.00 60.65 58.69 1bry s ILE 216 Cb -0.04 -3.18 0.07 0.00 -1.58 0.00 0.00 42.46 37.73 1bry s ILE 216 CO 0.17 0.47 0.44 -0.90 -1.23 0.00 0.00 174.94 173.89 1bry n ASP 217 N 3.46 0.36 0.30 3.58 5.68 0.32 -4.21 116.55 126.03 1bry n ASP 217 Ca -0.17 -1.36 0.16 0.00 -0.50 0.00 0.00 54.79 52.93 1bry n ASP 217 Cb 0.52 -0.31 0.96 0.00 -1.14 0.00 0.00 41.12 41.16 1bry n ASP 217 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1bry h GLY 218 N -0.39 0.00 -2.33 6.12 0.00 -1.98 -0.53 103.07 103.96 1bry h GLY 218 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.19 1bry h GLY 218 CO 0.13 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.37 1bry n ASN 219 N -3.71 3.46 -0.67 0.19 3.02 -1.26 -4.91 115.26 111.38 1bry n ASN 219 Ca -0.03 -2.16 -0.09 0.00 -0.03 0.00 0.00 54.58 52.27 1bry n ASN 219 Cb 0.09 -0.45 -0.04 0.00 -0.61 0.00 0.00 39.78 38.77 1bry n ASN 219 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1bry n ASN 220 N 1.04 -4.35 -4.86 6.41 3.02 -0.21 -5.00 115.26 111.30 1bry n ASN 220 Ca 0.20 0.22 -0.35 0.00 -0.03 0.00 0.00 54.58 54.61 1bry n ASN 220 Cb 0.60 -2.63 -0.06 0.00 -0.61 0.00 0.00 39.78 37.09 1bry n ASN 220 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1bry s GLN 221 N -2.56 3.76 0.29 3.52 -1.52 -1.26 -4.80 119.66 117.09 1bry s GLN 221 Ca 0.00 0.18 -0.28 0.00 -1.95 0.00 0.00 55.36 53.31 1bry s GLN 221 Cb 0.00 -3.04 -0.09 0.00 -0.22 0.00 0.00 33.01 29.65 1bry s GLN 221 CO 0.00 0.59 0.97 1.03 -0.25 0.00 0.00 175.29 177.63 1bry s ARG 222 N -1.75 4.67 -0.03 2.91 0.52 -1.26 -0.52 118.95 123.48 1bry s ARG 222 Ca 0.31 1.46 -0.00 0.00 -0.52 0.00 0.00 55.73 56.97 1bry s ARG 222 Cb -0.14 -3.02 0.03 0.00 0.52 0.00 0.00 34.95 32.34 1bry s ARG 222 CO 0.17 0.34 0.02 0.54 0.02 0.00 0.00 175.30 176.39 1bry s VAL 223 N -1.40 0.07 -0.15 3.52 0.11 0.42 -4.92 120.40 118.05 1bry s VAL 223 Ca 0.46 0.20 -0.25 0.00 -2.93 0.00 0.00 61.98 59.47 1bry s VAL 223 Cb -0.23 -0.22 -0.02 0.00 -1.53 0.00 0.00 36.38 34.38 1bry s VAL 223 CO 0.29 0.15 0.80 -0.44 -3.33 0.00 0.00 175.10 172.57 1bry s SER 224 N 1.38 6.95 -0.19 3.54 0.01 -1.26 -0.96 113.70 123.16 1bry s SER 224 Ca -0.05 1.16 -0.16 0.00 1.31 0.00 0.00 55.95 58.21 1bry s SER 224 Cb -0.13 -2.44 -0.04 0.00 0.21 0.00 0.00 66.02 63.62 1bry s SER 224 CO -0.03 -0.34 0.39 -0.63 0.41 0.00 0.00 173.24 173.05 1bry s ILE 225 N 1.87 5.21 0.00 1.44 -1.09 0.12 -4.93 121.20 123.82 1bry s ILE 225 Ca 0.38 0.70 0.00 0.00 -2.23 0.00 0.00 60.65 59.50 1bry s ILE 225 Cb -0.17 -3.72 0.00 0.00 -1.58 0.00 0.00 42.46 36.99 1bry s ILE 225 CO 0.14 0.27 0.16 0.35 -1.23 0.00 0.00 174.94 174.63 1bry n THR 226 N 4.25 0.00 -3.79 2.92 -2.24 -1.26 -1.46 114.28 112.71 1bry n THR 226 Ca -0.09 -0.22 -0.09 0.00 -2.27 0.00 0.00 64.05 61.38 1bry n THR 226 Cb 0.51 1.42 -0.04 0.00 -2.10 0.00 0.00 70.33 70.12 1bry n THR 226 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1bry s ASN 227 N -0.11 -0.24 0.00 3.42 2.20 -1.26 -1.24 114.94 117.70 1bry s ASN 227 Ca 0.00 -0.55 0.16 0.00 -0.94 0.00 0.00 52.86 51.53 1bry s ASN 227 Cb 0.00 0.60 0.89 0.00 -2.00 0.00 0.00 41.25 40.74 1bry s ASN 227 CO 0.00 -1.11 1.40 0.00 -2.94 0.00 0.00 177.10 174.45 1bry n ALA 228 N -0.37 2.00 1.23 3.54 0.00 0.12 -2.42 120.51 124.62 1bry n ALA 228 Ca -0.08 -0.09 0.13 0.00 0.00 0.00 0.00 53.44 53.40 1bry n ALA 228 Cb 0.62 -1.26 0.34 0.00 0.00 0.00 0.00 19.45 19.15 1bry n ALA 228 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1bry n SER 229 N -1.12 1.14 -4.76 0.00 7.64 -1.26 -4.44 113.62 110.82 1bry n SER 229 Ca 0.10 -0.97 -0.38 0.00 1.01 0.00 0.00 58.87 58.64 1bry n SER 229 Cb 0.08 0.17 0.02 0.00 -1.01 0.00 0.00 64.21 63.47 1bry n SER 229 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1bry s ALA 230 N -2.49 2.86 0.36 -0.43 0.00 -1.01 -4.79 121.76 116.26 1bry s ALA 230 Ca 0.24 1.18 0.07 0.00 0.00 0.00 0.00 51.96 53.45 1bry s ALA 230 Cb 0.19 -3.50 0.76 0.00 0.00 0.00 0.00 23.12 20.58 1bry s ALA 230 CO 0.52 -1.11 1.93 -0.09 0.00 0.00 0.00 175.76 177.01 1bry h ARG 231 N 1.65 0.72 0.00 0.00 2.43 -1.92 0.34 114.38 117.60 1bry h ARG 231 Ca -0.50 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 58.61 1bry h ARG 231 Cb 1.28 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 30.67 1bry h ARG 231 CO 0.58 0.48 -0.08 -0.24 -1.51 0.00 0.00 179.97 179.20 1bry h VAL 232 N 0.74 0.88 0.18 0.20 3.04 -1.91 0.32 116.25 119.70 1bry h VAL 232 Ca 0.35 -0.28 -0.33 0.00 -1.01 0.00 0.00 66.70 65.43 1bry h VAL 232 Cb 0.39 1.16 0.01 0.00 -2.01 0.00 0.00 31.29 30.84 1bry h VAL 232 CO -0.13 0.07 -1.65 0.58 -1.01 0.00 0.00 177.57 175.43 1bry h VAL 233 N 0.00 0.98 0.00 1.51 2.07 -1.28 -1.34 116.25 118.19 1bry h VAL 233 Ca -0.00 -2.49 -0.11 0.00 0.82 0.00 0.00 66.70 64.92 1bry h VAL 233 Cb 0.15 2.77 -0.02 0.00 -1.52 0.00 0.00 31.29 32.68 1bry h VAL 233 CO 0.01 0.82 -0.85 0.71 0.02 0.00 0.00 177.57 178.28 1bry h THR 234 N 0.01 0.58 -0.25 2.57 1.35 -1.01 -3.42 112.91 112.75 1bry h THR 234 Ca -0.33 -1.93 -0.21 0.00 -0.55 0.00 0.00 66.41 63.39 1bry h THR 234 Cb 2.02 2.16 -0.39 0.00 -1.73 0.00 0.00 68.15 70.22 1bry h THR 234 CO 0.16 0.33 -1.05 -1.20 -0.25 0.00 0.00 175.52 173.51 1bry n SER 235 N -3.04 1.23 0.00 5.36 7.64 0.11 -4.98 113.62 119.94 1bry n SER 235 Ca -0.02 -2.02 0.00 0.00 1.01 0.00 0.00 58.87 57.84 1bry n SER 235 Cb 0.74 -0.37 0.00 0.00 -1.01 0.00 0.00 64.21 63.57 1bry n SER 235 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1bry n ASN 236 N -0.19 0.00 -4.66 6.43 2.85 -1.22 -4.81 115.26 113.66 1bry n ASN 236 Ca 0.05 0.00 -0.46 0.00 -0.11 0.00 0.00 54.58 54.06 1bry n ASN 236 Cb 0.93 0.26 -0.04 0.00 1.24 0.00 0.00 39.78 42.17 1bry n ASN 236 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1bry n ILE 237 N -1.98 0.01 0.26 -1.44 3.06 -0.51 -1.10 119.36 117.66 1bry n ILE 237 Ca 0.00 -0.00 0.03 0.00 -2.50 0.00 0.00 62.75 60.28 1bry n ILE 237 Cb 0.00 -1.49 -0.02 0.00 0.54 0.00 0.00 39.64 38.68 1bry n ILE 237 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1bry n ALA 238 N 3.40 2.66 -3.28 1.51 0.00 0.93 -4.87 120.51 120.87 1bry n ALA 238 Ca 0.17 -0.25 -0.13 0.00 0.00 0.00 0.00 53.44 53.23 1bry n ALA 238 Cb 0.28 -0.20 -0.10 0.00 0.00 0.00 0.00 19.45 19.43 1bry n ALA 238 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1bry s LEU 239 N -1.84 0.54 -0.12 0.00 1.43 -1.25 -4.06 118.68 113.38 1bry s LEU 239 Ca 0.03 0.69 0.01 0.00 -1.03 0.00 0.00 54.13 53.84 1bry s LEU 239 Cb 0.04 1.35 -0.01 0.00 0.03 0.00 0.00 46.19 47.60 1bry s LEU 239 CO 0.19 -0.18 -0.17 -0.76 0.23 0.00 0.00 176.35 175.66 1bry s LEU 240 N -0.02 2.51 0.11 1.79 1.43 0.22 -4.95 118.68 119.77 1bry s LEU 240 Ca -0.02 -0.41 -0.31 0.00 -1.03 0.00 0.00 54.13 52.36 1bry s LEU 240 Cb -0.03 -1.55 -0.08 0.00 0.03 0.00 0.00 46.19 44.57 1bry s LEU 240 CO 0.01 0.16 1.35 -0.22 0.23 0.00 0.00 176.35 177.88 1bry s LEU 241 N 0.37 4.37 0.28 1.79 2.96 -1.26 -1.22 118.68 125.97 1bry s LEU 241 Ca -0.13 2.27 -0.30 0.00 -0.22 0.00 0.00 54.13 55.75 1bry s LEU 241 Cb -0.17 -3.59 -0.11 0.00 0.50 0.00 0.00 46.19 42.83 1bry s LEU 241 CO 0.07 -0.61 1.55 0.21 -1.32 0.00 0.00 176.35 176.25 1bry s ASN 242 N 1.03 6.45 0.56 3.68 3.84 -1.26 -4.65 114.94 124.59 1bry s ASN 242 Ca 0.63 2.87 0.26 0.00 0.21 0.00 0.00 52.86 56.84 1bry s ASN 242 Cb -0.35 -2.63 1.48 0.00 -0.55 0.00 0.00 41.25 39.20 1bry s ASN 242 CO 0.31 -0.85 2.01 0.08 -2.79 0.00 0.00 177.10 175.86 1bry h ARG 243 N 4.86 0.00 0.00 0.43 0.11 -1.92 0.20 114.38 118.06 1bry h ARG 243 Ca -0.47 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.61 1bry h ARG 243 Cb 1.22 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.30 1bry h ARG 243 CO 0.79 0.00 0.00 0.09 0.10 0.00 0.00 179.97 180.95 1bry n ASN 244 N -4.09 0.61 -0.77 0.08 3.02 -1.26 -1.73 115.26 111.12 1bry n ASN 244 Ca 0.07 0.70 0.07 0.00 -0.03 0.00 0.00 54.58 55.39 1bry n ASN 244 Cb 0.51 -0.81 0.20 0.00 -0.61 0.00 0.00 39.78 39.07 1bry n ASN 244 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1bry n ASN 245 N -2.23 3.40 -4.22 6.41 3.02 0.68 -4.94 115.26 117.38 1bry n ASN 245 Ca 0.01 -2.46 -0.33 0.00 -0.03 0.00 0.00 54.58 51.77 1bry n ASN 245 Cb 0.15 -0.38 -0.16 0.00 -0.61 0.00 0.00 39.78 38.78 1bry n ASN 245 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1bry s ILE 246 N -1.82 2.30 -2.00 2.41 1.01 -0.70 -4.97 121.20 117.42 1bry s ILE 246 Ca 0.32 -0.90 0.13 0.00 0.00 0.00 0.00 60.65 60.19 1bry s ILE 246 Cb 0.22 -1.93 0.36 0.00 0.01 0.00 0.00 42.46 41.12 1bry s ILE 246 CO 0.13 0.54 1.18 0.00 0.00 0.00 0.00 174.94 176.79